UCSF

Maybridge Building Blocks

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

Binding 10μM Targets with Highest Number of Available Compounds (142 in total)

Name (Uniprot) Swissprot ChEMBL Description Size Browse Download (Annotations)
C11B1_HUMAN P15538 CHEMBL1908 Cytochrome P450 11B1 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
C11B2_HUMAN P19099 CHEMBL2722 Cytochrome P450 11B2 7 Annotations Catalogs SMILES SDF Mol2 Flexibase
GSK3B_HUMAN P49841 CHEMBL262 Glycogen synthase kinase-3 beta 5 Annotations Catalogs SMILES SDF Mol2 Flexibase
EST1_HUMAN P23141 CHEMBL2265 Acyl coenzyme A:cholesterol acyltransferase 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
EST2_HUMAN O00748 CHEMBL3180 Carboxylesterase 2 4 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1A_RAT P19327 CHEMBL273 Serotonin 1a (5-HT1a) receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2A_RAT P14842 CHEMBL322 Serotonin 2a (5-HT2a) receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2B_RAT P30994 CHEMBL323 Serotonin 2b (5-HT2b) receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2C_RAT P08909 CHEMBL324 Serotonin 2c (5-HT2c) receptor 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA7_HUMAN P36544 CHEMBL2492 Neuronal acetylcholine receptor protein alpha-7 subunit 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH2_HUMAN P00918 CHEMBL205 Carbonic anhydrase II 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
HCAR2_HUMAN Q8TDS4 CHEMBL3785 Nicotinic acid receptor 1 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
NOS2_HUMAN P35228 CHEMBL4481 Nitric oxide synthase, inducible 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
OXDA_HUMAN P14920 CHEMBL5485 D-amino-acid oxidase 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A1_HUMAN P30531 CHEMBL1903 GABA transporter 1 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A1_RAT P23978 CHEMBL4054 GABA transporter 1 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50597 Z50597 CHEMBL376 Rattus norvegicus 3 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1B_RAT P28564 CHEMBL3459 Serotonin 1b (5-HT1b) receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1D_RAT P28565 CHEMBL5450 Serotonin 1d (5-HT1d) receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1F_RAT P30940 CHEMBL4646 Serotonin 1f (5-HT1f) receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
A3EZI9_9HEPC A3EZI9 CHEMBL4893 Hepatitis C virus NS3 protease/helicase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
AA3R_HUMAN P33765 CHEMBL256 Adenosine A3 receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACES_HUMAN P22303 CHEMBL220 Acetylcholinesterase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACH10_RAT Q9JLB5 CHEMBL3461 Neuronal acetylcholine receptor protein alpha-10 subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA3_RAT P04757 CHEMBL3818 Neuronal acetylcholine receptor protein alpha-3 subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ACHA4_RAT P09483 CHEMBL307 Neuronal acetylcholine receptor protein alpha-4 subunit 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
ALDR_HUMAN P15121 CHEMBL1900 Aldose reductase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH12_HUMAN O43570 CHEMBL3242 Carbonic anhydrase XII 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH14_HUMAN Q9ULX7 CHEMBL3510 Carbonic anhydrase XIV 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH15_MOUSE Q99N23 CHEMBL5973 Carbonic anhydrase 15 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH1_HUMAN P00915 CHEMBL261 Carbonic anhydrase I 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH9_HUMAN Q16790 CHEMBL3594 Carbonic anhydrase IX 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CP17A_RAT P11715 CHEMBL4430 Cytochrome P450 17A1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
CP19A_HUMAN P11511 CHEMBL1978 Cytochrome P450 19A1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DEF_STAAM P68825 CHEMBL2367 Peptide deformylase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DNLI1_HUMAN P18858 CHEMBL5694 DNA ligase 1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD2_HUMAN P14416 CHEMBL217 Dopamine D2 receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
DRD3_HUMAN P35462 CHEMBL234 Dopamine D3 receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
EST1_RABIT P12337 CHEMBL2623 Acyl coenzyme A:cholesterol acyltransferase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
HCAR2_RAT Q80Z39 CHEMBL4731 HM74 nicotinic acid GPCR 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRH3_RAT Q9QYN8 CHEMBL4124 Histamine H3 receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
I23O1_HUMAN P14902 CHEMBL4685 Indoleamine 2,3-dioxygenase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
NOS1_HUMAN P29475 CHEMBL3568 Nitric-oxide synthase, brain 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
NOS3_HUMAN P29474 CHEMBL4803 Nitric-oxide synthase, endothelial 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q3I4V7_CRYNV Q3I4V7 CHEMBL1697676 Carbonic anhydrase 2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q5AJ71_CANAL Q5AJ71 CHEMBL5337 Carbonic anhydrase 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Y1284_MYCTU P64797 CHEMBL5631 Uncharacterized protein Rv1284/MT1322 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104283 Z104283 CHEMBL1907589 Neuronal acetylcholine receptor; alpha4/beta2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104290 Z104290 CHEMBL1907596 Neuronal acetylcholine receptor; alpha4/beta2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104301 Z104301 CHEMBL1907607 GABA-A receptor; anion channel 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104304 Z104304 CHEMBL1907610 Adrenergic receptor alpha-1 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1A_HUMAN P08908 CHEMBL214 Serotonin 1a (5-HT1a) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1B_HUMAN P28222 CHEMBL1898 Serotonin 1b (5-HT1b) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT1D_HUMAN P28221 CHEMBL1983 Serotonin 1d (5-HT1d) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2A_HUMAN P28223 CHEMBL224 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
5HT2C_HUMAN P28335 CHEMBL225 Serotonin 2c (5-HT2c) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT6R_HUMAN P50406 CHEMBL3371 Serotonin 6 (5-HT6) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT7R_HUMAN P34969 CHEMBL3155 Serotonin 7 (5-HT7) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
A4_HUMAN P05067 CHEMBL2487 Beta amyloid A4 protein 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2A_RAT P22909 CHEMBL327 Alpha-2a adrenergic receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2B_RAT P19328 CHEMBL266 Alpha-2b adrenergic receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADA2C_RAT P22086 CHEMBL314 Alpha-2c adrenergic receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AK1C3_HUMAN P42330 CHEMBL4681 Aldo-keto-reductase family 1 member C3 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ALDR_RAT P07943 CHEMBL2622 Aldose reductase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AMD_HUMAN P19021 CHEMBL2544 Peptidyl-glycine alpha-amidating monooxygenase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AOFA_HUMAN P21397 CHEMBL1951 Monoamine oxidase A 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH13_MOUSE Q9D6N1 CHEMBL2186 Carbonic anhydrase XIII 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH4_BOVIN Q95323 CHEMBL281 Carbonic anhydrase IV 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH4_HUMAN P22748 CHEMBL3729 Carbonic anhydrase IV 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH5A_HUMAN P35218 CHEMBL4789 Carbonic anhydrase VA 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CAH_METTE P40881 CHEMBL3932 Carbonic anhydrase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CATK_HUMAN P43235 CHEMBL268 Cathepsin K 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CATL1_HUMAN P07711 CHEMBL3837 Cathepsin L 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CTRA_BOVIN P00766 CHEMBL3314 Alpha-chymotrypsin 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DHB3_HUMAN P37058 CHEMBL4234 Estradiol 17-beta-dehydrogenase 3 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
DRD3_RAT P19020 CHEMBL3138 Dopamine D3 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
DRD5_RAT P25115 CHEMBL2281 Dopamine D5 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
EPYC_HUMAN Q99645 CHEMBL2080 Small chondroitin/dermatan sulfate proteoglycan 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
FABPL_RAT P02692 CHEMBL5738 Fatty acid-binding protein, liver 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
FYN_HUMAN P06241 CHEMBL1841 Tyrosine-protein kinase FYN 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GABR1_HUMAN Q9UBS5 CHEMBL2064 GABA-B receptor 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GABR1_RAT Q9Z0U4 CHEMBL2753 GABA-B receptor 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GABR2_HUMAN O75899 CHEMBL5034 GABA-B receptor 2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GABR2_RAT O88871 CHEMBL4686 GABA-B receptor 2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA1_HUMAN P14867 CHEMBL1962 GABA receptor alpha-1 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRA1_RAT P62813 CHEMBL343 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
GBRA2_RAT P23576 CHEMBL341 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
GBRB1_HUMAN P18505 CHEMBL4558 GABA receptor beta-1 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRB2_HUMAN P47870 CHEMBL1920 GABA receptor beta-2 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRB3_HUMAN P28472 CHEMBL1847 GABA receptor beta-3 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRD_HUMAN O14764 CHEMBL3591 GABA receptor delta subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRE_HUMAN P78334 CHEMBL4635 GABA receptor epsilon subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRG1_HUMAN Q8N1C3 CHEMBL4044 GABA receptor gamma-1 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRG1_RAT P23574 CHEMBL296 GABA receptor gamma-1 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRG2_HUMAN P18507 CHEMBL1788 GABA receptor gamma-2 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRG3_HUMAN Q99928 CHEMBL2739 GABA receptor gamma-3 subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRP_HUMAN O00591 CHEMBL3506 GABA receptor pi subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GBRT_HUMAN Q9UN88 CHEMBL2843 GABA receptor theta subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HCAR2_MOUSE Q9EP66 CHEMBL4420 HM74 nicotinic acid GPCR 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRH3_HUMAN Q9Y5N1 CHEMBL264 Histamine H3 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HS90A_HUMAN P07900 CHEMBL3880 Heat shock protein HSP 90-alpha 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
I23O1_MOUSE P28776 CHEMBL1075294 Indoleamine 2,3-dioxygenase 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
KPCA_HUMAN P17252 CHEMBL299 Protein kinase C alpha 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
KPCB_HUMAN P05771 CHEMBL3045 Protein kinase C beta 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
LCK_HUMAN P06239 CHEMBL258 Tyrosine-protein kinase LCK 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
LIPS_RAT P15304 CHEMBL5582 Hormone-sensitive lipase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
METC_ECOLI P06721 CHEMBL1075079 Cystathionine beta-lyase metC 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MGLL_HUMAN Q99685 CHEMBL4191 Monoglyceride lipase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
NHAA_ECOLI P13738 CHEMBL5478 Na(+)/H(+) antiporter nhaA 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
NOS1_RAT P29476 CHEMBL3048 Nitric-oxide synthase, brain 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
OXDA_PIG P00371 CHEMBL6172 D-amino-acid oxidase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
P96878_MYCTU P96878 CHEMBL5767 PROBABLE TRANSMEMBRANE CARBONIC ANHYDRASE (CARBONATE DEHYDRATASE) (CARBONIC DEHYDRATASE) 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH1_HUMAN P23219 CHEMBL221 Cyclooxygenase-1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH1_RAT Q63921 CHEMBL4042 Cyclooxygenase-1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH1_SHEEP P05979 CHEMBL2949 Cyclooxygenase-1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH2_HUMAN P35354 CHEMBL230 Cyclooxygenase-2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGH2_RAT P35355 CHEMBL2977 Cyclooxygenase-2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PIM1_HUMAN P11309 CHEMBL2147 Serine/threonine-protein kinase PIM1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PPARA_MOUSE P23204 CHEMBL2128 Peroxisome proliferator-activated 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
S1PR5_HUMAN Q9H228 CHEMBL2274 Sphingosine 1-phosphate receptor Edg-8 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
S22A6_MOUSE Q8VC69 CHEMBL5653 Solute carrier family 22 member 6 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
S22AK_MOUSE Q80UJ1 CHEMBL5269 Solute carrier family 22 member 20 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
S6A11_HUMAN P48066 CHEMBL5208 GABA transporter 3 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
S6A13_RAT P31646 CHEMBL4889 GABA transporter 2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A1_MOUSE P31648 CHEMBL5445 GABA transporter 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
TAAR1_HUMAN Q96RJ0 CHEMBL5857 Trace amine-associated receptor 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
THRB_HUMAN P00734 CHEMBL204 Thrombin 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
TRY1_BOVIN P00760 CHEMBL3769 Trypsin I 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
TRY1_HUMAN P07477 CHEMBL209 Trypsin I 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
UCHL3_HUMAN P15374 CHEMBL6195 Ubiquitin carboxyl-terminal hydrolase isozyme L3 1 Annotations Catalogs SMILES SDF Mol2 Flexibase