UCSF

Focus Synthesis BB

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

Binding 10μM Targets with Highest Number of Available Compounds (119 in total)

Name (Uniprot) Swissprot ChEMBL Description Size Browse Download (Annotations)
GSK3B_HUMAN P49841 CHEMBL262 Glycogen synthase kinase-3 beta 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
IMDH2_HUMAN P12268 CHEMBL2002 Inosine-5'-monophosphate dehydrogenase 2 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
SC6A3_RAT P23977 CHEMBL338 Dopamine transporter 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
V1AR_HUMAN P37288 CHEMBL1889 Vasopressin V1a receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
V1AR_RAT P30560 CHEMBL2868 Vasopressin V1a receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
V1BR_HUMAN P47901 CHEMBL1921 Vasopressin V1b receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
V1BR_RAT P48974 CHEMBL2659 Vasopressin V1b receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
V2R_HUMAN P30518 CHEMBL1790 Vasopressin V2 receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
V2R_RAT Q00788 CHEMBL3766 Vasopressin V2 receptor 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z50587 Z50587 CHEMBL372 Homo sapiens 2 Annotations Catalogs SMILES SDF Mol2 Flexibase
5HT2A_HUMAN P28223 CHEMBL224 Serotonin 2a (5-HT2a) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
A3EZI9_9HEPC A3EZI9 CHEMBL4893 Hepatitis C virus NS3 protease/helicase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AAK1_HUMAN Q2M2I8 CHEMBL3830 Adaptor-associated kinase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ABL1_HUMAN P00519 CHEMBL1862 Tyrosine-protein kinase ABL 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ABL2_HUMAN P42684 CHEMBL4014 Tyrosine-protein kinase ABL2 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
ACM2_RAT P10980 CHEMBL309 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
ACM3_RAT P08483 CHEMBL320 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
ADCK3_HUMAN Q8NI60 CHEMBL5550 Chaperone activity of bc1 complex-like, mitochondrial 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ADCK4_HUMAN Q96D53 CHEMBL5753 Uncharacterized aarF domain-containing protein kinase 4 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AGTR1_HUMAN P30556 CHEMBL227 Angiotensin II type 1 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AGTRA_RAT P25095 CHEMBL329 Angiotensin II type 1a (AT-1a) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AGTRB_RAT P29089 CHEMBL263 Angiotensin II type 1b (AT-1b) receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ALK_HUMAN Q9UM73 CHEMBL4247 ALK tyrosine kinase receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AURKA_HUMAN O14965 CHEMBL4722 Serine/threonine-protein kinase Aurora-A 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AURKB_HUMAN Q96GD4 CHEMBL2185 Serine/threonine-protein kinase Aurora-B 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
AURKC_HUMAN Q9UQB9 CHEMBL3935 Serine/threonine-protein kinase Aurora-C 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
BLK_HUMAN P51451 CHEMBL2250 Tyrosine-protein kinase BLK 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
BMP2K_HUMAN Q9NSY1 CHEMBL4522 BMP-2-inducible protein kinase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CCL2_HUMAN P13500 CHEMBL1649052 C-C motif chemokine 2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
CTRO_HUMAN O14578 CHEMBL5579 Citron Rho-interacting kinase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DDR1_HUMAN Q08345 CHEMBL5319 Epithelial discoidin domain-containing receptor 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
DMPK_HUMAN Q09013 CHEMBL5320 Myotonin-protein kinase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
E2AK2_HUMAN P19525 CHEMBL5785 Interferon-induced, double-stranded RNA-activated protein kinase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
E2AK4_HUMAN Q9P2K8 CHEMBL5358 Eukaryotic translation initiation factor 2-alpha kinase 4 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
EGFR_HUMAN P00533 CHEMBL203 Epidermal growth factor receptor erbB1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
EPHA3_HUMAN P29320 CHEMBL4954 Ephrin type-A receptor 3 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
EPHA6_HUMAN Q9UF33 CHEMBL4526 Ephrin type-A receptor 6 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
EPHA7_HUMAN Q15375 CHEMBL4602 Ephrin type-A receptor 7 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
EPHA8_HUMAN P29322 CHEMBL4134 Ephrin type-A receptor 8 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ERBB2_HUMAN P04626 CHEMBL1824 Receptor protein-tyrosine kinase erbB-2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ERBB4_HUMAN Q15303 CHEMBL3009 Receptor protein-tyrosine kinase erbB-4 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
FGFR2_HUMAN P21802 CHEMBL4142 Fibroblast growth factor receptor 2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
FGR_HUMAN P09769 CHEMBL4454 Tyrosine-protein kinase FGR 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
FLT3_HUMAN P36888 CHEMBL1974 Tyrosine-protein kinase receptor FLT3 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
FPPS_HUMAN P14324 CHEMBL1782 Farnesyl diphosphate synthase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
FRK_HUMAN P42685 CHEMBL4223 Tyrosine-protein kinase FRK 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GAK_HUMAN O14976 CHEMBL4355 Serine/threonine-protein kinase GAK 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GGPPS_HUMAN O95749 CHEMBL4769 Geranylgeranyl pyrophosphate synthetase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
GGPPS_YEAST Q12051 CHEMBL1075251 Geranylgeranyl pyrophosphate synthase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HCK_HUMAN P08631 CHEMBL3234 Tyrosine-protein kinase HCK 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRH1_HUMAN P35367 CHEMBL231 Histamine H1 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
HRH3_RAT Q9QYN8 CHEMBL4124 Histamine H3 receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
IMDH1_HUMAN P20839 CHEMBL1822 Inosine-5'-monophosphate dehydrogenase 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ISPA_ECOLI P22939 CHEMBL1075078 Geranyltranstransferase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
JAK3_HUMAN P52333 CHEMBL2148 Tyrosine-protein kinase JAK3 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
KAPCA_HUMAN P17612 CHEMBL4101 cAMP-dependent protein kinase alpha-catalytic subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
KAPCB_HUMAN P22694 CHEMBL2918 cAMP-dependent protein kinase beta-1 catalytic subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
KAPCG_HUMAN P22612 CHEMBL2743 cAMP-dependent protein kinase, gamma catalytic subunit 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
KC1D_HUMAN P48730 CHEMBL2828 Casein kinase I delta 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
KIT_HUMAN P10721 CHEMBL1936 Stem cell growth factor receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
KPCE_HUMAN Q02156 CHEMBL3582 Protein kinase C epsilon 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
KS6A4_HUMAN O75676 CHEMBL3125 Ribosomal protein S6 kinase alpha 4 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
KS6A5_HUMAN O75582 CHEMBL4237 Ribosomal protein S6 kinase alpha 5 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
LCK_HUMAN P06239 CHEMBL258 Tyrosine-protein kinase LCK 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
LTK_HUMAN P29376 CHEMBL5627 Leukocyte tyrosine kinase receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
LYN_HUMAN P07948 CHEMBL3905 Tyrosine-protein kinase Lyn 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MET_HUMAN P08581 CHEMBL3717 Hepatocyte growth factor receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MK04_HUMAN P31152 CHEMBL5759 Mitogen-activated protein kinase 4 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MK09_HUMAN P45984 CHEMBL4179 c-Jun N-terminal kinase 2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MKNK1_HUMAN Q9BUB5 CHEMBL4718 MAP kinase-interacting serine/threonine-protein kinase MNK1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MKNK2_HUMAN Q9HBH9 CHEMBL4204 MAP kinase signal-integrating kinase 2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MRCKG_HUMAN Q6DT37 CHEMBL5615 Serine/threonine-protein kinase MRCK gamma 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MYLK2_HUMAN Q9H1R3 CHEMBL2777 myosin light chain kinase 2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
MYLK_HUMAN Q15746 CHEMBL2428 Myosin light chain kinase, smooth muscle 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
OXDA_HUMAN P14920 CHEMBL5485 D-amino-acid oxidase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
OXDA_RAT O35078 CHEMBL5756 D-amino-acid oxidase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGFRA_HUMAN P16234 CHEMBL2007 Platelet-derived growth factor receptor alpha 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PGFRB_HUMAN P09619 CHEMBL1913 Platelet-derived growth factor receptor beta 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PKN1_HUMAN Q16512 CHEMBL3384 Protein kinase N1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PKN2_HUMAN Q16513 CHEMBL3032 Protein kinase N2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
PTAFR_HUMAN P25105 CHEMBL250 Platelet activating factor receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q0GKD7_LEIDO Q0GKD7 CHEMBL3693 Farnesyl pyrophosphate synthase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q72874_9HIV1 Q72874 CHEMBL243 Human immunodeficiency virus type 1 protease 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Q7ZJM1_9HIV1 Q7ZJM1 CHEMBL3471 Human immunodeficiency virus type 1 integrase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
RARA_HUMAN P10276 CHEMBL2055 Retinoic acid receptor alpha 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
RARB_HUMAN P10826 CHEMBL2008 Retinoic acid receptor beta 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
RARG_HUMAN P13631 CHEMBL2003 Retinoic acid receptor gamma 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
RET_HUMAN P07949 CHEMBL2041 Tyrosine-protein kinase receptor RET 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
RIPK2_HUMAN O43353 CHEMBL5014 Serine/threonine-protein kinase RIPK2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ROCK1_HUMAN Q13464 CHEMBL3231 Rho-associated protein kinase 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ROCK2_HUMAN O75116 CHEMBL2973 Rho-associated protein kinase 2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ROCK2_RAT Q62868 CHEMBL5490 Rho-associated protein kinase 2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
RXRA_HUMAN P19793 CHEMBL2061 Retinoid X receptor alpha 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
RXRA_MOUSE P28700 CHEMBL3084 Retinoid X receptor alpha 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
RXRB_HUMAN P28702 CHEMBL1870 Retinoid X receptor beta 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
RXRB_MOUSE P28704 CHEMBL4047 Retinoid X receptor beta 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
RXRG_HUMAN P48443 CHEMBL2004 Retinoid X receptor gamma 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
RXRG_MOUSE P28705 CHEMBL4402 Retinoid X receptor gamma 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
SLK_HUMAN Q9H2G2 CHEMBL4202 Serine/threonine-protein kinase 2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
SRC_HUMAN P12931 CHEMBL267 Tyrosine-protein kinase SRC 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
STK10_HUMAN O94804 CHEMBL3981 Serine/threonine-protein kinase 10 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
TBA1A_RAT P68370 CHEMBL4139 Tubulin alpha-1 chain 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
TIE1_HUMAN P35590 CHEMBL5274 Tyrosine-protein kinase receptor Tie-1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
TNI3K_HUMAN Q59H18 CHEMBL5260 Serine/threonine-protein kinase TNNI3K 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
TNK1_HUMAN Q13470 CHEMBL5334 Non-receptor tyrosine-protein kinase TNK1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
TOP2A_HUMAN P11388 CHEMBL1806 DNA topoisomerase II alpha 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
TYRO3_HUMAN Q06418 CHEMBL5314 Tyrosine-protein kinase receptor TYRO3 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
ULK3_MOUSE Q3U3Q1 CHEMBL3832 ULK3 kinase 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
VGFR1_HUMAN P17948 CHEMBL1868 Vascular endothelial growth factor receptor 1 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
VGFR3_HUMAN P35916 CHEMBL1955 Vascular endothelial growth factor receptor 3 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
YES_HUMAN P07947 CHEMBL2073 Tyrosine-protein kinase YES 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z100250 Z100250 CHEMBL612514 Calf thymus DNA 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104290 Z104290 CHEMBL1907596 Neuronal acetylcholine receptor; alpha4/beta2 1 Annotations Catalogs SMILES SDF Mol2 Flexibase
Z104302 Z104302 CHEMBL1907608 Glutamate NMDA receptor 1 Annotations Catalogs SMILES SDF Mol2 Flexibase