UCSF

SMPDB Small Molecule Pathway Database

Binding 10μM Binding 1μM Functional 10μM ADME/T 10μM

Functional 10μM Targets with Highest Number of Available Compounds (585 in total)

Name (Uniprot) Swissprot ChEMBL Description Size Browse Download (Annotations)
Z50425 Z50425 CHEMBL364 Plasmodium falciparum 54 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50597 Z50597 CHEMBL376 Rattus norvegicus 32 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50512 Z50512 CHEMBL369 Cavia porcellus 21 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50594 Z50594 CHEMBL375 Mus musculus 20 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80224 Z80224 CHEMBL387 MCF7 (Breast carcinoma cells) 18 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50587 Z50587 CHEMBL372 Homo sapiens 15 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80193 Z80193 CHEMBL386 L1210 (Lymphocytic leukemia cells) 15 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80682 Z80682 CHEMBL392 A549 (Lung carcinoma cells) 14 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A4_RAT P31652 CHEMBL313 Serotonin transporter 13 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80156 Z80156 CHEMBL383 HL-60 (Promyeloblast leukemia cells) 13 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50592 Z50592 CHEMBL374 Oryctolagus cuniculus 12 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80874 Z80874 CHEMBL393 CEM (T-cell leukemia) 12 Annotations Catalogs SMILES SDF Mol2 Flexibase
GPBAR_HUMAN Q8TDU6 CHEMBL5409 G-protein coupled bile acid receptor 1 11 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q9WTR4_RAT Q9WTR4 CHEMBL304 Norepinephrine transporter 11 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80166 Z80166 CHEMBL384 HT-29 (Colon adenocarcinoma cells) 11 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80712 Z80712 CHEMBL614361 T47D (Breast carcinoma cells) 11 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81252 Z81252 CHEMBL400 MDA-MB-231 (Breast adenocarcinoma cells) 11 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80583 Z80583 CHEMBL391 Vero (Kidney cells) 10 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81247 Z81247 CHEMBL399 HeLa (Cervical adenocarcinoma cells) 10 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80186 Z80186 CHEMBL385 K562 (Erythroleukemia cells) 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80390 Z80390 CHEMBL390 PC-3 (Prostate carcinoma cells) 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81020 Z81020 CHEMBL395 HepG2 (Hepatoblastoma cells) 9 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50466 Z50466 CHEMBL368 Trypanosoma cruzi 8 Annotations Catalogs SMILES SDF Mol2 Flexibase
ESR1_HUMAN P03372 CHEMBL206 Estrogen receptor alpha 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50607 Z50607 CHEMBL378 Human immunodeficiency virus 1 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80125 Z80125 CHEMBL613508 DU-145 (Prostate carcinoma) 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80295 Z80295 CHEMBL388 MT4 (Lymphocytes) 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80548 Z80548 CHEMBL614245 THP-1 (Acute monocytic leukemia cells) 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80928 Z80928 CHEMBL394 HCT-116 (Colon carcinoma cells) 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81072 Z81072 CHEMBL397 Jurkat (Acute leukemic T-cells) 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81135 Z81135 CHEMBL614793 L6 (Skeletal muscle myoblast cells) 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81335 Z81335 CHEMBL612263 HCT-15 (Colon adenocarcinoma cells) 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
ESR2_HUMAN Q92731 CHEMBL242 Estrogen receptor beta 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH1_HUMAN P23219 CHEMBL221 Cyclooxygenase-1 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50606 Z50606 CHEMBL613497 Hepatitis B virus 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80064 Z80064 CHEMBL382 CCRF-CEM (T-cell leukemia) 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80362 Z80362 CHEMBL389 P388 (Lymphoma cells) 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80475 Z80475 CHEMBL613834 SK-BR-3 (Breast adenocarcinoma) 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81024 Z81024 CHEMBL396 NCI-H460 (Non-small cell lung carcinoma) 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81170 Z81170 CHEMBL612518 LNCaP (Prostate carcinoma) 6 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRH2_HUMAN P25021 CHEMBL1941 Histamine H2 receptor 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
P2RY6_HUMAN Q15077 CHEMBL4714 Pyrimidinergic receptor P2Y6 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH2_HUMAN P35354 CHEMBL230 Cyclooxygenase-2 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80482 Z80482 CHEMBL614917 SK-MEL-2 (Melanoma cells) 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80485 Z80485 CHEMBL614919 SK-MEL-28 (Melanoma cells) 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80526 Z80526 CHEMBL612544 SW480 (Colon adenocarcinoma cells) 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81034 Z81034 CHEMBL614004 A2780 (Ovarian carcinoma cells) 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81115 Z81115 CHEMBL398 KB (Squamous cell carcinoma) 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1B_HUMAN P28222 CHEMBL1898 Serotonin 1b (5-HT1b) receptor 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB1_HUMAN P08588 CHEMBL213 Beta-1 adrenergic receptor 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1C_RAT P22002 CHEMBL3762 Voltage-gated L-type calcium channel alpha-1C subunit 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1D_RAT P27732 CHEMBL4132 Voltage-gated L-type calcium channel alpha-1D subunit 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
CXCR1_HUMAN P25024 CHEMBL4029 Interleukin-8 receptor A 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
CXCR2_HUMAN P25025 CHEMBL2434 Interleukin-8 receptor B 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
MCR_HUMAN P08235 CHEMBL1994 Mineralocorticoid receptor 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
P2RY2_HUMAN P41231 CHEMBL4398 Purinergic receptor P2Y2 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z103203 Z103203 CHEMBL1075388 A375 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50588 Z50588 CHEMBL373 Canis familiaris 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50658 Z50658 CHEMBL380 Human immunodeficiency virus 2 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50725 Z50725 CHEMBL612348 Trypanosoma brucei rhodesiense 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80025 Z80025 CHEMBL614519 ACHN (Renal adenocarcinoma cells) 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80076 Z80076 CHEMBL614548 CEM-SS (T-cell leukemia) 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80164 Z80164 CHEMBL614580 HT-1080 (Fibrosarcoma cells) 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80211 Z80211 CHEMBL614721 LoVo (Colon adenocarcinoma cells) 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80493 Z80493 CHEMBL614925 SK-OV-3 (Ovarian carcinoma cells) 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80532 Z80532 CHEMBL614774 T-24 (Bladder carcinoma cells) 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80561 Z80561 CHEMBL615023 U2OS (Osteosarcoma cells) 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80563 Z80563 CHEMBL615025 U-373 MG ( Glioblastoma cells) 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80608 Z80608 CHEMBL614393 ZR-75-1 (Breast carcinoma cells) 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81245 Z81245 CHEMBL614697 MDA-MB-435 (Breast carcinoma cells) 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA2AR_RAT P30543 CHEMBL302 Adenosine A2a receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ANDR_HUMAN P10275 CHEMBL1871 Androgen Receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ANDR_RAT P15207 CHEMBL3072 Androgen Receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1C_HUMAN Q13936 CHEMBL1940 Voltage-gated L-type calcium channel alpha-1C subunit 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1D_HUMAN Q01668 CHEMBL4138 Voltage-gated L-type calcium channel alpha-1D subunit 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD2_HUMAN P14416 CHEMBL217 Dopamine D2 receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
OPRM_HUMAN P35372 CHEMBL233 Mu opioid receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
P2RY4_RAT O35811 CHEMBL2124 Pyrimidinergic receptor P2Y4 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
P2Y14_HUMAN Q15391 CHEMBL4518 Purinergic receptor P2Y14 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
P97706_RAT P97706 CHEMBL4957 Sodium channel protein type VI alpha subunit 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH1_MOUSE P22437 CHEMBL2649 Cyclooxygenase-1 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH2_MOUSE Q05769 CHEMBL4321 Cyclooxygenase-2 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH2_SHEEP P79208 CHEMBL4102 Cyclooxygenase-2 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
PPARG_HUMAN P37231 CHEMBL235 Peroxisome proliferator-activated receptor gamma 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
PPARG_MOUSE P37238 CHEMBL2459 Peroxisome proliferator-activated receptor gamma 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
SCN5A_RAT P15389 CHEMBL3866 Sodium channel protein type V alpha subunit 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
TRPA1_MOUSE Q8BLA8 CHEMBL1075310 Transient receptor potential cation channel subfamily A member 1 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z100081 Z100081 CHEMBL613107 PBMC (Peripheral blood mononuclear cells) 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z103205 Z103205 CHEMBL1075390 A431 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50472 Z50472 CHEMBL612888 Toxoplasma gondii 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50518 Z50518 CHEMBL613124 Human herpesvirus 4 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50643 Z50643 CHEMBL379 Hepatitis C virus 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50677 Z50677 CHEMBL613758 Human immunodeficiency virus 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80008 Z80008 CHEMBL612565 5637 (Epithelial bladder carcinoma cells) 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80035 Z80035 CHEMBL381 B16 (Melanoma cells) 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80052 Z80052 CHEMBL614533 C8166 (Leukemic T-cells) 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80054 Z80054 CHEMBL614058 Caco-2 (Colon adenocarcinoma cells) 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80088 Z80088 CHEMBL613853 CHO (Ovarian cells) 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80132 Z80132 CHEMBL614293 EL4 (Thymoma cells) 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80188 Z80188 CHEMBL614590 KB 3-1 (Cervical epithelial carcinoma cells) 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80227 Z80227 CHEMBL614324 MCF7-ADR (Breast carcinoma cells) 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80269 Z80269 CHEMBL614354 MKN-45 (Gastric adenocarcinoma cells) 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80285 Z80285 CHEMBL614177 MOLT-4 (Acute T-lymphoblastic leukemia cells) 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80322 Z80322 CHEMBL614135 NCI-H358 (Lung carcinama cells) 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80490 Z80490 CHEMBL614923 SK-MES-1 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80565 Z80565 CHEMBL614247 U-87 MG (Glioblastoma cells) 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80600 Z80600 CHEMBL613533 XF498 (Glioma cells) 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80640 Z80640 CHEMBL613102 786-0 (Renal carcinoma cells) 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80954 Z80954 CHEMBL614071 HFF (Foreskin fibroblasts) 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81017 Z81017 CHEMBL614647 WiDr (Colon adenocarcinoma cells) 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81043 Z81043 CHEMBL613969 N592 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81054 Z81054 CHEMBL613977 SF-268 (Glioblastoma cells) 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81057 Z81057 CHEMBL613979 HUVEC (Umbilical vein endothelial cells) 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81264 Z81264 CHEMBL614074 V79 (Lung fibroblasts) 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81331 Z81331 CHEMBL612262 SW-620 (Colon adenocarcinoma cells) 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA2BR_HUMAN P29275 CHEMBL255 Adenosine A2b receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA2BR_RAT P29276 CHEMBL2592 Adenosine A2b receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2B_HUMAN P18089 CHEMBL1942 Alpha-2b adrenergic receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB1_RAT P18090 CHEMBL3252 Beta-1 adrenergic receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB2_HUMAN P07550 CHEMBL210 Beta-2 adrenergic receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB2_RAT P10608 CHEMBL3754 Beta-2 adrenergic receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB3_HUMAN P13945 CHEMBL246 Beta-3 adrenergic receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB3_RAT P26255 CHEMBL4031 Beta-3 adrenergic receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
AGTR1_HUMAN P30556 CHEMBL227 Angiotensin II type 1 receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
AGTR2_HUMAN P50052 CHEMBL4607 Angiotensin II type 2 (AT-2) receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
AGTRA_RAT P25095 CHEMBL329 Angiotensin II type 1a (AT-1a) receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
AGTRB_RAT P29089 CHEMBL263 Angiotensin II type 1b (AT-1b) receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ATP4A_HUMAN P20648 CHEMBL1802 Potassium-transporting ATPase alpha chain 1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ATP4B_HUMAN P51164 CHEMBL5207 Potassium-transporting ATPase beta chain 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1E_RAT Q07652 CHEMBL4115 Voltage-gated R-type calcium channel alpha-1E subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1S_RAT Q02485 CHEMBL4108 Voltage-gated L-type calcium channel alpha-1S subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH2_HUMAN P00918 CHEMBL205 Carbonic anhydrase II 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH4_BOVIN Q95323 CHEMBL281 Carbonic anhydrase IV 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
EGFR_HUMAN P00533 CHEMBL203 Epidermal growth factor receptor erbB1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ERBB2_HUMAN P04626 CHEMBL1824 Receptor protein-tyrosine kinase erbB-2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
FFAR1_HUMAN O14842 CHEMBL4422 Free fatty acid receptor 1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRR2_HUMAN P28476 CHEMBL2375 GABA receptor rho-2 subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
GCR_HUMAN P04150 CHEMBL2034 Glucocorticoid receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
HMDH_HUMAN P04035 CHEMBL402 HMG-CoA reductase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ITA2B_HUMAN P08514 CHEMBL212 Integrin alpha-IIb 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ITB3_HUMAN P05106 CHEMBL207 Integrin beta-3 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
KCNH2_HUMAN Q12809 CHEMBL240 HERG 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
MDR1_HUMAN P08183 CHEMBL4302 P-glycoprotein 1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
MDR1_MOUSE P06795 CHEMBL3467 P-glycoprotein 1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
NR1H4_HUMAN Q96RI1 CHEMBL2047 Bile acid receptor FXR 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
OPRD_HUMAN P41143 CHEMBL236 Delta opioid receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
OPRD_MOUSE P32300 CHEMBL3222 Delta opioid receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
OPRM_CAVPO P97266 CHEMBL4354 Mu opioid receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
OPRM_MOUSE P42866 CHEMBL2858 Mu opioid receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
OPRM_RAT P33535 CHEMBL270 Mu opioid receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
P2RX1_HUMAN P51575 CHEMBL2094 P2X purinoceptor 1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
P2RY1_HUMAN P47900 CHEMBL4315 Purinergic receptor P2Y1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
P2RY1_RAT P49651 CHEMBL2497 Purinergic receptor P2Y1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
P2RY2_MOUSE P35383 CHEMBL1075298 P2Y purinoceptor 2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
P2RY2_RAT P41232 CHEMBL4419 Purinergic receptor P2Y2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
P2RY4_HUMAN P51582 CHEMBL2123 Pyrimidinergic receptor P2Y4 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
P2Y11_HUMAN Q96G91 CHEMBL4867 Purinergic receptor P2Y11 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
P2Y12_RAT Q9EPX4 CHEMBL2188 Purinergic receptor P2Y12 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH1_RAT Q63921 CHEMBL4042 Cyclooxygenase-1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH2_RAT P35355 CHEMBL2977 Cyclooxygenase-2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
PPARA_HUMAN Q07869 CHEMBL239 Peroxisome proliferator-activated receptor alpha 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
RARA_HUMAN P10276 CHEMBL2055 Retinoic acid receptor alpha 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
RARB_HUMAN P10826 CHEMBL2008 Retinoic acid receptor beta 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
RARG_HUMAN P13631 CHEMBL2003 Retinoic acid receptor gamma 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
RXRA_HUMAN P19793 CHEMBL2061 Retinoid X receptor alpha 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
RXRB_HUMAN P28702 CHEMBL1870 Retinoid X receptor beta 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
RXRG_HUMAN P48443 CHEMBL2004 Retinoid X receptor gamma 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A3_RAT P23977 CHEMBL338 Dopamine transporter 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
SCN8A_RAT O88420 CHEMBL2752 Sodium channel protein type VIII alpha subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
TLR2_HUMAN O60603 CHEMBL4163 Toll-like receptor 2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
TOP1_HUMAN P11387 CHEMBL1781 DNA topoisomerase I 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
TOP1_MOUSE Q04750 CHEMBL2814 DNA topoisomerase I 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
TOP2A_HUMAN P11388 CHEMBL1806 DNA topoisomerase II alpha 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
TOP2A_MOUSE Q01320 CHEMBL3586 DNA topoisomerase II alpha 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
TOP2B_HUMAN Q02880 CHEMBL3396 DNA topoisomerase II beta 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
TOP2B_MOUSE Q64511 CHEMBL5564 DNA topoisomerase II beta 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z100733 Z100733 CHEMBL613866 CT26 (Colon carcinoma cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z100741 Z100741 CHEMBL614867 MC9 (Mast cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z101865 Z101865 CHEMBL612790 Leishmania chagasi 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z102020 Z102020 CHEMBL613016 Porcine endogenous retrovirus 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z102306 Z102306 CHEMBL613606 Aorta 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z103204 Z103204 CHEMBL1075389 A427 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104304 Z104304 CHEMBL1907610 Adrenergic receptor alpha-1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50380 Z50380 CHEMBL613088 Mycobacterium smegmatis 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50426 Z50426 CHEMBL612856 Plasmodium falciparum (isolate K1 / Thailand) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50457 Z50457 CHEMBL612877 Leishmania amazonensis 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50458 Z50458 CHEMBL612878 Leishmania braziliensis 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50460 Z50460 CHEMBL612879 Leishmania major 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50602 Z50602 CHEMBL377 Human herpesvirus 1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50611 Z50611 CHEMBL613500 Moloney murine leukemia virus 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50612 Z50612 CHEMBL613501 Moloney murine sarcoma virus 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50759 Z50759 CHEMBL612373 Dictyostelium discoideum 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80021 Z80021 CHEMBL614516 A498 (Renal carcinoma cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80026 Z80026 CHEMBL613860 AGS (Gastric adenocarcinoma cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80048 Z80048 CHEMBL614530 BXPC-3 (Pancreatic adenocarcinoma cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80068 Z80068 CHEMBL614542 CCRF-SB (Lymphoblastic leukemia cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80106 Z80106 CHEMBL614563 COS-1 (Kidney cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80112 Z80112 CHEMBL614033 DAN-G 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80120 Z80120 CHEMBL614285 DLD-1 (Colon adenocarcinoma cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80145 Z80145 CHEMBL614045 H69 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80169 Z80169 CHEMBL614039 Huh-7 (Hepatocellular carcinoma) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80192 Z80192 CHEMBL614709 KM12 (Colon adenocarcinoma cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80214 Z80214 CHEMBL614317 M14 (Melanoma cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80244 Z80244 CHEMBL614335 MDA-MB-468 (Breast adenocarcinoma) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80254 Z80254 CHEMBL614343 MES-SA (Uterine sarcoma cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80255 Z80255 CHEMBL613827 MES-SA/DxS (Uterine sarcoma cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80291 Z80291 CHEMBL614181 MRC5 (Embryonic lung fibroblast cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80296 Z80296 CHEMBL614185 MVLN 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80354 Z80354 CHEMBL614213 OVCAR-3 (Ovarian adenocarcinoma cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80364 Z80364 CHEMBL614218 P388/ADR (Lymphoma cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80414 Z80414 CHEMBL614628 Raji (B-lymphoblastic cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80433 Z80433 CHEMBL614882 RPMI-8226 (Multiple myeloma cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80457 Z80457 CHEMBL614901 SCC-25 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80466 Z80466 CHEMBL614907 SF268 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80468 Z80468 CHEMBL614908 SF-295 (Glioblastoma cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80491 Z80491 CHEMBL614163 SK-N-MC (Neuroepithelioma cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80559 Z80559 CHEMBL615021 U251 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80560 Z80560 CHEMBL615022 U-251 (Glioma cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80661 Z80661 CHEMBL614567 A704 (Renal carcinoma cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80697 Z80697 CHEMBL614279 Bel-7402 (Hepatoma cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80711 Z80711 CHEMBL613829 NCI/ADR-RES (Breast carcinoma cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80726 Z80726 CHEMBL614367 TRAMP-C1A (Prostate carcinoma cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80730 Z80730 CHEMBL614368 C2D cell line 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80731 Z80731 CHEMBL613541 C2G cell line 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80732 Z80732 CHEMBL614369 TRAMP-C2H (Prostate carcinoma cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80742 Z80742 CHEMBL614657 C6 (Glioma cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80819 Z80819 CHEMBL614484 J774.2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80846 Z80846 CHEMBL614493 F460pv8/eto cell line 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80847 Z80847 CHEMBL612250 FaDu (Pharyngeal carcinoma cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80852 Z80852 CHEMBL614069 A-431 (Epidermoid carcinoma cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80889 Z80889 CHEMBL614803 NCI-H322M (Non-small cell lung carcinoma cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80896 Z80896 CHEMBL614805 NCI-H69 (Small cell lung carcinoma cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80902 Z80902 CHEMBL614150 HASMC (Aortic smooth muscle cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80945 Z80945 CHEMBL614735 HEp-2 (Laryngeal carcinoma cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80952 Z80952 CHEMBL614662 HES 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81065 Z81065 CHEMBL613984 IGROV-1 (Ovarian adenocarcinoma cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81068 Z81068 CHEMBL614649 Ishikawa (Uterine carcinoma cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81117 Z81117 CHEMBL613995 Keratinocytes (Keratinocytes) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81138 Z81138 CHEMBL613872 ScN2a (Scrapie-infected neuroblastoma cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81160 Z81160 CHEMBL614088 Lewis lung carcinoma cell line 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81184 Z81184 CHEMBL614096 LOX IMVI (Melanoma cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81244 Z81244 CHEMBL614123 J774 (Macrophage cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81248 Z81248 CHEMBL614021 Malme-3M (Melanoma cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81280 Z81280 CHEMBL614740 NCI-H226 (Non-small cell lung carcinoma cells) 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81284 Z81284 CHEMBL614999 NCI-H647 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81338 Z81338 CHEMBL614309 T-cells 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1A_HUMAN P08908 CHEMBL214 Serotonin 1a (5-HT1a) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1D_HUMAN P28221 CHEMBL1983 Serotonin 1d (5-HT1d) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1F_HUMAN P30939 CHEMBL1805 Serotonin 1f (5-HT1f) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2A_HUMAN P28223 CHEMBL224 Serotonin 2a (5-HT2a) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2A_RAT P14842 CHEMBL322 Serotonin 2a (5-HT2a) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2B_HUMAN P41595 CHEMBL1833 Serotonin 2b (5-HT2b) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2B_RAT P30994 CHEMBL323 Serotonin 2b (5-HT2b) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2C_HUMAN P28335 CHEMBL225 Serotonin 2c (5-HT2c) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2C_RAT P08909 CHEMBL324 Serotonin 2c (5-HT2c) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3A_HUMAN P46098 CHEMBL1899 Serotonin 3a (5-HT3a) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT3A_MOUSE P23979 CHEMBL4972 Serotonin 3a (5-HT3a) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT4R_HUMAN Q13639 CHEMBL1875 Serotonin 4 (5-HT4) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT4R_RAT Q62758 CHEMBL4317 Serotonin 4 (5-HT4) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT7R_HUMAN P34969 CHEMBL3155 Serotonin 7 (5-HT7) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA1R_HUMAN P30542 CHEMBL226 Adenosine A1 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA2AR_HUMAN P29274 CHEMBL251 Adenosine A2a receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA3R_HUMAN P33765 CHEMBL256 Adenosine A3 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA3_HUMAN P32297 CHEMBL3068 Neuronal acetylcholine receptor protein alpha-3 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA3_RAT P04757 CHEMBL3818 Neuronal acetylcholine receptor protein alpha-3 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA4_HUMAN P43681 CHEMBL1882 Neuronal acetylcholine receptor protein alpha-4 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA7_HUMAN P36544 CHEMBL2492 Neuronal acetylcholine receptor protein alpha-7 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA7_RAT Q05941 CHEMBL4980 Neuronal acetylcholine receptor protein alpha-7 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHD_TORCA P02718 CHEMBL3916 Acetylcholine receptor protein delta chain 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM1_HUMAN P11229 CHEMBL216 Muscarinic acetylcholine receptor M1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM2_HUMAN P08172 CHEMBL211 Muscarinic acetylcholine receptor M2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM3_HUMAN P20309 CHEMBL245 Muscarinic acetylcholine receptor M3 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM4_HUMAN P08173 CHEMBL1821 Muscarinic acetylcholine receptor M4 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACM5_HUMAN P08912 CHEMBL2035 Muscarinic acetylcholine receptor M5 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1A_HUMAN P35348 CHEMBL229 Alpha-1a adrenergic receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1A_RABIT O02824 CHEMBL3637 Alpha-1a adrenergic receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA1D_RABIT O02666 CHEMBL4407 Alpha-1d adrenergic receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2A_HUMAN P08913 CHEMBL1867 Alpha-2a adrenergic receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2C_HUMAN P18825 CHEMBL1916 Alpha-2c adrenergic receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCY1_HUMAN Q08828 CHEMBL2899 Brain adenylate cyclase 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCY2_HUMAN Q08462 CHEMBL3760 Adenylate cyclase type II 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCY2_RAT P26769 CHEMBL2958 Adenylate cyclase type II 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCY8_HUMAN P40145 CHEMBL2960 Adenylate cyclase type VIII 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADRB2_CANFA P54833 CHEMBL2289 Beta-2 adrenergic receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AGTR1_BOVIN P25104 CHEMBL3374 Angiotensin II type 1a (AT-1a) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AGTR1_RABIT P34976 CHEMBL3948 Angiotensin II type 1a (AT-1a) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AGTR2_RAT P35351 CHEMBL257 Angiotensin II type 2 (AT-2) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ARP19_RAT Q712U5 CHEMBL2170 cyclic AMP phosphoprotein 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
BRAF_HUMAN P15056 CHEMBL5145 Serine/threonine-protein kinase B-raf 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1F_HUMAN O60840 CHEMBL5593 Voltage-gated L-type calcium channel alpha-1F subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAC1S_HUMAN Q13698 CHEMBL3805 Voltage-gated L-type calcium channel alpha-1S subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DHB1_HUMAN P14061 CHEMBL3181 Estradiol 17-beta-dehydrogenase 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD1_HUMAN P21728 CHEMBL2056 Dopamine D1 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD1_RAT P18901 CHEMBL265 Dopamine D1 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD2_RAT P61169 CHEMBL339 Dopamine D2 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD4_HUMAN P21917 CHEMBL219 Dopamine D4 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD4_RAT P30729 CHEMBL3361 Dopamine D4 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DYR_LACCA P00381 CHEMBL2902 Dihydrofolate reductase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ERG1_HUMAN Q14534 CHEMBL3592 Squalene monooxygenase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ERG7_HUMAN P48449 CHEMBL3593 Lanosterol synthase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ERR1_HUMAN P11474 CHEMBL3429 Estrogen-related receptor alpha 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ERR2_HUMAN O95718 CHEMBL3751 Estrogen-related receptor beta 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ERR3_HUMAN P62508 CHEMBL4245 Estrogen-related receptor gamma 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ESR2_RAT Q62986 CHEMBL3021 Estrogen receptor beta 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
FDFT_HUMAN P37268 CHEMBL3338 Squalene synthetase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GABR1_HUMAN Q9UBS5 CHEMBL2064 GABA-B receptor 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA1_HUMAN P14867 CHEMBL1962 GABA receptor alpha-1 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA2_HUMAN P47869 CHEMBL4956 GABA receptor alpha-2 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA3_HUMAN P34903 CHEMBL3026 GABA receptor alpha-3 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA4_HUMAN P48169 CHEMBL2472 GABA receptor alpha-4 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA5_HUMAN P31644 CHEMBL5112 GABA receptor alpha-5 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA6_HUMAN Q16445 CHEMBL2579 GABA receptor alpha-6 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRB3_HUMAN P28472 CHEMBL1847 GABA receptor beta-3 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRG2_HUMAN P18507 CHEMBL1788 GABA receptor gamma-2 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRR1_HUMAN P24046 CHEMBL3561 GABA receptor rho-1 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRR3_HUMAN A8MPY1 CHEMBL2394 GABA receptor rho-3 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GCR_RAT P06536 CHEMBL3368 Glucocorticoid receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GPBAR_MOUSE Q80SS6 CHEMBL1255150 G-protein coupled bile acid receptor 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GPER_HUMAN Q99527 CHEMBL5872 G-protein coupled estrogen receptor 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GRIA1_HUMAN P42261 CHEMBL2009 Glutamate receptor ionotropic, AMPA 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GRIA1_RAT P19490 CHEMBL3753 Glutamate receptor ionotropic, AMPA 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GRIA2_HUMAN P42262 CHEMBL4016 Glutamate receptor ionotropic, AMPA 2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GRIA3_HUMAN P42263 CHEMBL3595 Glutamate receptor ionotropic, AMPA 3 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GRIA3_RAT P19492 CHEMBL3504 Glutamate receptor ionotropic, AMPA 3 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GRM1_HUMAN Q13255 CHEMBL3772 Metabotropic glutamate receptor 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GRM1_RAT P23385 CHEMBL4477 Metabotropic glutamate receptor 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GRM2_HUMAN Q14416 CHEMBL5137 Metabotropic glutamate receptor 2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GRM2_RAT P31421 CHEMBL2851 Metabotropic glutamate receptor 2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GRM3_HUMAN Q14832 CHEMBL2888 Metabotropic glutamate receptor 3 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GRM3_RAT P31422 CHEMBL3067 Metabotropic glutamate receptor 3 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GRM4_RAT P31423 CHEMBL2787 Metabotropic glutamate receptor 4 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GRM5_RAT P31424 CHEMBL2564 Metabotropic glutamate receptor 5 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GRM6_RAT P35349 CHEMBL3842 Metabotropic glutamate receptor 6 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GRM8_HUMAN O00222 CHEMBL3228 Metabotropic glutamate receptor 8 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HCAR2_HUMAN Q8TDS4 CHEMBL3785 Nicotinic acid receptor 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HCAR2_MOUSE Q9EP66 CHEMBL4420 HM74 nicotinic acid GPCR 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HCAR2_RAT Q80Z39 CHEMBL4731 HM74 nicotinic acid GPCR 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRH1_HUMAN P35367 CHEMBL231 Histamine H1 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRH3_HUMAN Q9Y5N1 CHEMBL264 Histamine H3 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRH3_RAT Q9QYN8 CHEMBL4124 Histamine H3 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRH4_HUMAN Q9H3N8 CHEMBL3759 Histamine H4 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ICAM1_HUMAN P05362 CHEMBL3070 Intercellular adhesion molecule-1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ITAL_HUMAN P20701 CHEMBL1803 Leukocyte adhesion glycoprotein LFA-1 alpha 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ITPR1_RAT P29994 CHEMBL2804 Inositol 1,4,5-trisphosphate receptor type 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
KITH_HUMAN P04183 CHEMBL2883 Thymidine kinase, cytosolic 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
LOX5_HUMAN P09917 CHEMBL215 Arachidonate 5-lipoxygenase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MDFA_ECOLI P0AEY8 CHEMBL4785 Multidrug translocase mdfA 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MDR3_MOUSE P21447 CHEMBL2573 P-glycoprotein 3 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MP2K1_HUMAN Q02750 CHEMBL3587 Dual specificity mitogen-activated protein kinase kinase 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MTR1A_CHICK P49285 CHEMBL4555 Melatonin receptor 1A 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MTR1A_HUMAN P48039 CHEMBL1945 Melatonin receptor 1A 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MTR1B_CHICK P51050 CHEMBL4466 Melatonin receptor 1B 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MTR1B_HUMAN P49286 CHEMBL1946 Melatonin receptor 1B 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MTR1C_CHICK P49288 CHEMBL3196 Melatonin receptor 1C 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
NMDE1_RAT Q00959 CHEMBL310 Glutamate [NMDA] receptor subunit epsilon 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
NMDZ1_RAT P35439 CHEMBL330 Glutamate (NMDA) receptor subunit zeta 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
O3FA1_HUMAN Q5NUL3 CHEMBL5339 G-protein coupled receptor 120 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
OPRD_PIG P79291 CHEMBL4103 Delta opioid receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
OPRK_HUMAN P41145 CHEMBL237 Kappa opioid receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
OPRK_MOUSE P33534 CHEMBL4329 Kappa opioid receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
OXER1_HUMAN Q8TDS5 CHEMBL1628461 Oxoeicosanoid receptor 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
P2RX1_RAT P47824 CHEMBL2530 P2X purinoceptor 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
P2RX2_RAT P49653 CHEMBL2135 P2X purinoceptor 2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
P2RX3_HUMAN P56373 CHEMBL2998 P2X purinoceptor 3 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
P2RX4_HUMAN Q99571 CHEMBL2104 P2X purinoceptor 4 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
P2RX4_RAT P51577 CHEMBL2818 P2X purinoceptor 4 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
P2RX5_RAT P51578 CHEMBL2495 P2X purinoceptor 5 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
P2RX6_RAT P51579 CHEMBL2122 P2X purinoceptor 6 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
P2RY1_MELGA P49652 CHEMBL5720 P2Y purinoceptor 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
P2RY6_RAT Q63371 CHEMBL3543 Pyrimidinergic receptor P2Y6 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
P2Y12_HUMAN Q9H244 CHEMBL2001 Purinergic receptor P2Y12 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PE2R2_RAT Q62928 CHEMBL4909 Prostanoid EP2 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PE2R4_HUMAN P35408 CHEMBL1836 Prostanoid EP4 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PE2R4_RAT P43114 CHEMBL4086 Prostanoid EP4 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH1_BOVIN O62664 CHEMBL2860 Cyclooxygenase-1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH2_BOVIN O62698 CHEMBL3331 Cyclooxygenase-2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PRGR_HUMAN P06401 CHEMBL208 Progesterone receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q72547_9HIV1 Q72547 CHEMBL247 Human immunodeficiency virus type 1 reverse transcriptase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
RAF1_HUMAN P04049 CHEMBL1906 Serine/threonine-protein kinase RAF 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
RXRA_RAT Q05343 CHEMBL4431 Retinoid X receptor alpha 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
S1PR1_HUMAN P21453 CHEMBL4333 Sphingosine 1-phosphate receptor Edg-1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
S1PR3_HUMAN Q99500 CHEMBL3892 Sphingosine 1-phosphate receptor Edg-3 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
S6A11_RAT P31647 CHEMBL3598 GABA transporter 3 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
S6A12_RAT P48056 CHEMBL5248 Betaine transporter 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
S6A13_RAT P31646 CHEMBL4889 GABA transporter 2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A1_RAT P23978 CHEMBL4054 GABA transporter 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A4_HUMAN P31645 CHEMBL228 Serotonin transporter 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
SGMR1_HUMAN Q99720 CHEMBL287 Sigma opioid receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
SHBG_HUMAN P04278 CHEMBL3305 Testis-specific androgen-binding protein 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
SHBG_RAT P08689 CHEMBL4932 Testis-specific androgen-binding protein 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
TAAR1_HUMAN Q96RJ0 CHEMBL5857 Trace amine-associated receptor 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
THAS_HUMAN P24557 CHEMBL1835 Thromboxane-A synthase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
TRPA1_HUMAN O75762 CHEMBL6007 Transient receptor potential cation channel subfamily A member 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
VGFR1_HUMAN P17948 CHEMBL1868 Vascular endothelial growth factor receptor 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
VGFR2_HUMAN P35968 CHEMBL279 Vascular endothelial growth factor receptor 2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
VGFR3_HUMAN P35916 CHEMBL1955 Vascular endothelial growth factor receptor 3 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z100405 Z100405 CHEMBL613835 MV4-11 (Myeloid leukemia cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z100515 Z100515 CHEMBL612595 HPAC (Pancreatic adenocarcinoma) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z100752 Z100752 CHEMBL612568 Renca (Renal carcinoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z100757 Z100757 CHEMBL612570 SW1573 (Lung carcinoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z101682 Z101682 CHEMBL613915 BK polyomavirus 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z101767 Z101767 CHEMBL613966 Dengue virus 2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z101829 Z101829 CHEMBL612769 HBV genotype D 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z102178 Z102178 CHEMBL613694 Liver microsomes 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z102213 Z102213 CHEMBL613416 Blood 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z103196 Z103196 CHEMBL1075381 22RV1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z103219 Z103219 CHEMBL1075404 Ca9-22 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z103348 Z103348 CHEMBL1075533 NCI-H2122 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z103393 Z103393 CHEMBL1075578 SK-N-AS 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z103407 Z103407 CHEMBL1075592 SW1990 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z103413 Z103413 CHEMBL1075598 SW948 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z103419 Z103419 CHEMBL1075604 UACC-812 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104283 Z104283 CHEMBL1907589 Neuronal acetylcholine receptor; alpha4/beta2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104287 Z104287 CHEMBL1907593 Neuronal acetylcholine receptor; alpha3/beta4 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104288 Z104288 CHEMBL1907594 Neuronal acetylcholine receptor; alpha3/beta4 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104290 Z104290 CHEMBL1907596 Neuronal acetylcholine receptor; alpha4/beta2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50266 Z50266 CHEMBL357 Enterococcus faecium 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50347 Z50347 CHEMBL361 Saccharomyces cerevisiae 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50362 Z50362 CHEMBL613075 Lactobacillus casei 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50418 Z50418 CHEMBL612849 Trypanosoma brucei 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50442 Z50442 CHEMBL366 Candida albicans 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50459 Z50459 CHEMBL367 Leishmania donovani 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50515 Z50515 CHEMBL370 Human herpesvirus 2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50527 Z50527 CHEMBL613132 Human herpesvirus 3 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50530 Z50530 CHEMBL371 Human herpesvirus 5 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50590 Z50590 CHEMBL613488 Sus scrofa 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50591 Z50591 CHEMBL613489 Bos taurus 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50599 Z50599 CHEMBL612672 Cowpox virus 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50600 Z50600 CHEMBL613493 Vaccinia virus 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50641 Z50641 CHEMBL613730 West Nile virus 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50678 Z50678 CHEMBL612679 Respiratory syncytial virus 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50681 Z50681 CHEMBL613761 Duck hepatitis B virus 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50740 Z50740 CHEMBL612361 Cricetinae gen. sp. 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50755 Z50755 CHEMBL612370 Anas sp. 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80001 Z80001 CHEMBL614508 143B 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80014 Z80014 CHEMBL614514 A204 (Rhabdomyosarcoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80017 Z80017 CHEMBL614023 A2780cisR (Cisplatin-resistant ovarian carcinoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80018 Z80018 CHEMBL613859 A-375 (Malignant melanoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80019 Z80019 CHEMBL614515 A-427 (Lung carcinoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80039 Z80039 CHEMBL614526 BGC-823 (Stomach adenocarcinoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80040 Z80040 CHEMBL614527 BHK-21 (Kidney cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80045 Z80045 CHEMBL613870 BT-20 (Breast carcinoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80056 Z80056 CHEMBL613852 CAKI-2 (Renal carcinoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80063 Z80063 CHEMBL614027 CCRF S-180 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80086 Z80086 CHEMBL613506 CFPAC-1 (Pancreatic carcinoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80092 Z80092 CHEMBL614031 CHO-K1 (Ovarian cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80099 Z80099 CHEMBL614561 COLO 205 (Colon adenocarcinoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80101 Z80101 CHEMBL614562 COLO 320DM (Colon adenocarcinoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80105 Z80105 CHEMBL613854 COR-L23 (Lung carcinoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80110 Z80110 CHEMBL613507 CV-1 (Kidney cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80114 Z80114 CHEMBL614281 Daudi (Burkitts lymphoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80126 Z80126 CHEMBL614289 DuPro 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80133 Z80133 CHEMBL614294 EMT6 (Mammary carcinoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80135 Z80135 CHEMBL614296 F9 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80136 Z80136 CHEMBL614297 FM3A (Breast carcinoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80138 Z80138 CHEMBL614036 G-361 (Melanoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80171 Z80171 CHEMBL614582 HuTu80 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80175 Z80175 CHEMBL614585 IMR-32 (Neuroblastoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80178 Z80178 CHEMBL614040 J774.A1 (Macrophage cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80179 Z80179 CHEMBL614586 J82 (Bladder carcinoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80226 Z80226 CHEMBL614323 MCF7-2A 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80231 Z80231 CHEMBL614328 MCF7S (Breast carcinoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80232 Z80232 CHEMBL614128 MCF7-VP 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80240 Z80240 CHEMBL614129 MDA-MB-361 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80243 Z80243 CHEMBL614334 MDA-MB-453 (Breast adenocarcinoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80262 Z80262 CHEMBL614348 NCI-H1975 (Bronchoalveolar carcinoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80267 Z80267 CHEMBL614352 MKN-1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80268 Z80268 CHEMBL614353 MKN-28 (Gastric epithelial carcinoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80284 Z80284 CHEMBL614176 MOLT-3 (T-lymphoblastic leukemia cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80288 Z80288 CHEMBL614133 MOVP-3 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80294 Z80294 CHEMBL614184 MT2 (Lymphocytes) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80316 Z80316 CHEMBL614771 NCI-H128 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80330 Z80330 CHEMBL614197 NCI-N87 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80334 Z80334 CHEMBL613828 NG108-15 (Neuroblastoma-glioma hybrid cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80347 Z80347 CHEMBL614208 NUGC-3 (Gastric carcinoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80356 Z80356 CHEMBL614214 OVCAR-5 (Ovarian adenocarcinoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80357 Z80357 CHEMBL612555 OVCAR-8 (Ovarian adenocarcinoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80367 Z80367 CHEMBL614220 P388/S 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80377 Z80377 CHEMBL614228 PaCa2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80381 Z80381 CHEMBL614139 PANC-1 (Pancreatic carcinoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80387 Z80387 CHEMBL612556 PC-12 (Adrenal phaeochromacytoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80389 Z80389 CHEMBL614140 PC-14 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80401 Z80401 CHEMBL614241 PSN1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80407 Z80407 CHEMBL614383 R1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80408 Z80408 CHEMBL614384 R1-CCRF-CEM (Lymphoblastic leukemia) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80409 Z80409 CHEMBL614385 R2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80410 Z80410 CHEMBL613523 R2-CCRF-CEM (Lymphoblastic leukemia) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80411 Z80411 CHEMBL614143 R30dm-CCRF-CEM (Lymphoblastic leukemia) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80418 Z80418 CHEMBL612557 RAW264.7 (Monocytic-macrophage leukemia cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80435 Z80435 CHEMBL614145 RT-112 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80436 Z80436 CHEMBL614884 RT-4 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80441 Z80441 CHEMBL614889 RXF 944 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80443 Z80443 CHEMBL612567 S180 (Sarcoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80455 Z80455 CHEMBL614899 SCC-15 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80459 Z80459 CHEMBL614147 SCC-7 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80472 Z80472 CHEMBL612542 SiHa (Cervical squamous cell carcinoma) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80473 Z80473 CHEMBL613527 SISO 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80477 Z80477 CHEMBL614912 SK_HEP1 (Hepatoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80478 Z80478 CHEMBL614913 SK-LU-1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80479 Z80479 CHEMBL614914 SK-MEL (Melanoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80481 Z80481 CHEMBL614916 SK-MEL-1 (Metastatic melanoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80488 Z80488 CHEMBL614922 SK-MEL-5 (Melanoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80492 Z80492 CHEMBL614924 SK-N-SH (Neuroblastoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80495 Z80495 CHEMBL614927 SK-VLB 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80503 Z80503 CHEMBL614931 SNU1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80509 Z80509 CHEMBL614935 SNU-638 (Gastric carcinoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80525 Z80525 CHEMBL614055 SW48 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80539 Z80539 CHEMBL614775 T98G (Glioblastoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80546 Z80546 CHEMBL615013 TERT-RPE1 (Retinal pigmented epithelial cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80568 Z80568 CHEMBL612796 UACC-257 (Melanoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80570 Z80570 CHEMBL614610 UACC-62 (Melanoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80574 Z80574 CHEMBL612799 UMUC3 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80575 Z80575 CHEMBL614388 UO-31 (Renal carcinoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80581 Z80581 CHEMBL614248 VA13 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80595 Z80595 CHEMBL612810 WIL2-NS (Lymphoblastoid cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80601 Z80601 CHEMBL614060 XRS6 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80604 Z80604 CHEMBL612815 YAPC 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80641 Z80641 CHEMBL614254 791T cell line 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80653 Z80653 CHEMBL613105 9L (Glioma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80657 Z80657 CHEMBL614255 A253 cell line 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80686 Z80686 CHEMBL614274 AZ-521 cell line 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80702 Z80702 CHEMBL613537 BG-1 cell line 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80724 Z80724 CHEMBL614705 C170 cell line 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80735 Z80735 CHEMBL614739 C38 (Colon carcinoma) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80752 Z80752 CHEMBL614380 carcinoma cell line 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80768 Z80768 CHEMBL614455 CH1 (Ovarian carcinoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80773 Z80773 CHEMBL614456 CHRC/5 cell line 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80774 Z80774 CHEMBL614457 CHRC5 cell line 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80784 Z80784 CHEMBL614462 Col2 (Colon carcinoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80789 Z80789 CHEMBL614463 Colon 38 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80799 Z80799 CHEMBL612517 RPMI 8402 (Pre-T-lymphoblastoid cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80800 Z80800 CHEMBL614725 MIA PaCa-2 (Pancreatic carcinoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80801 Z80801 CHEMBL614151 CRL-7065 cell line 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80815 Z80815 CHEMBL612247 D54 cell line 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80830 Z80830 CHEMBL614641 Ehrlich (Ehrlich ascites carcinoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80866 Z80866 CHEMBL612707 GLC4 cell line 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80887 Z80887 CHEMBL614802 H2981 cell line 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80890 Z80890 CHEMBL614160 H350.3 (MTX-resistant Reuber hepatoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80891 Z80891 CHEMBL614804 H4 (Hepatoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80893 Z80893 CHEMBL614784 H35 (Reuber hepatoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80897 Z80897 CHEMBL614806 H9 (T-lymphoid cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80901 Z80901 CHEMBL614392 HaCaT (Keratinocytes) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80920 Z80920 CHEMBL613855 HCC 2998 (Colon adenocarcinoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80936 Z80936 CHEMBL614818 HEK293 (Embryonic kidney fibroblasts) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80943 Z80943 CHEMBL614819 HEL 299 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80947 Z80947 CHEMBL614820 Hepatoblastoma cell line 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80949 Z80949 CHEMBL614821 Hepatoma cell line 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80961 Z80961 CHEMBL614828 HN5 (Squamous cell carcinoma) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80991 Z80991 CHEMBL614645 Hs-578T (Breast carcinoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z80996 Z80996 CHEMBL614836 HT1197 (Bladder carcinoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81005 Z81005 CHEMBL614839 HTB-54 cell line 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81006 Z81006 CHEMBL612259 Human breast 401NL tumor cell line 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81008 Z81008 CHEMBL614788 Human breast cancer cell lines 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81011 Z81011 CHEMBL614840 human cell lines 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81025 Z81025 CHEMBL613890 Human lung LXF 529L tumor cell line 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81026 Z81026 CHEMBL614689 Human lung LXF 629L tumor cell line 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81028 Z81028 CHEMBL613892 Human melanoma cell line 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81041 Z81041 CHEMBL612424 Prostatic carcinoma cells 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81047 Z81047 CHEMBL614685 Human T-cell line 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81048 Z81048 CHEMBL613973 TSU (Prostatic carcinoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81074 Z81074 CHEMBL614687 K177cell line 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81101 Z81101 CHEMBL614010 KBM-3 cell line 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81102 Z81102 CHEMBL613994 KBM-3/DOX cell line 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81121 Z81121 CHEMBL613996 KKLS cell line 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81126 Z81126 CHEMBL613998 KYSE-150 cell line 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81128 Z81128 CHEMBL612701 KYSE-520 cell line 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81130 Z81130 CHEMBL614012 KYSE-70 cell line 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81133 Z81133 CHEMBL614000 L1210 (1565) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81134 Z81134 CHEMBL614650 L2987 (Lung adenocarcinoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81164 Z81164 CHEMBL614091 LL cell line 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81167 Z81167 CHEMBL614093 LLTC cell line 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81186 Z81186 CHEMBL614097 LS174T (Colon adencocarcinoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81201 Z81201 CHEMBL614643 HOP-62 (Non-small cell lung carcinoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81211 Z81211 CHEMBL614109 LXFL529 cell line 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81257 Z81257 CHEMBL614732 MEL-AC cell line 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81261 Z81261 CHEMBL614127 UACC-375 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81267 Z81267 CHEMBL614723 Mononuclear cell line 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81277 Z81277 CHEMBL613287 NCI-N417 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81281 Z81281 CHEMBL614997 NCI-H23 (Non-small cell lung carcinoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81283 Z81283 CHEMBL614387 NCI-H522 (Non-small cell lung carcinoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81322 Z81322 CHEMBL614860 SF-539 (Glioblastoma cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81325 Z81325 CHEMBL614300 SR (Leukemia cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81330 Z81330 CHEMBL614304 SNU- 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81341 Z81341 CHEMBL614310 Tumor cell lines 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z81346 Z81346 CHEMBL614313 Melanophores (Melanophore cells) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase