Molecule Details
InChIKeyKQWTXAWKBUUOMU-UHFFFAOYSA-N
Compound Name3-Methylthienyl-carbonyl-JNJ-7706621
Canonical SMILESCc1ccsc1C(=O)n1nc(Nc2ccc(S(N)(=O)=O)cc2)nc1N
Clinical Status Clinical Multi-Target
Targets (Human+Pathogen)20
Pfam Stratification Cross-Family
Avg pChEMBL7.56
SourceBindingDB;ChEMBL;TTD_MultiTarget
2D Structure
2D structure
Activity Profile
Target Activities (20)
Target Gene Organism Category Pfam pChEMBL Type Source
P20248 CCNA2 Homo sapiens Human PF02984 PF00134 PF16500 9.4 IC50 ChEMBL
P24941 CDK2 Homo sapiens Human PF00069 9.4 pIC50 TTD_MultiTarget
P78396 CCNA1 Homo sapiens Human PF02984 PF00134 PF16500 9.4 IC50 ChEMBL
O95067 CCNB2 Homo sapiens Human PF02984 PF00134 8.3 IC50 ChEMBL
P06493 CDK1 Homo sapiens Human PF00069 8.3 pIC50 TTD_MultiTarget
P11802 CDK4 Homo sapiens Human PF00069 8.3 pIC50 TTD_MultiTarget
P14635 CCNB1 Homo sapiens Human PF02984 PF00134 8.3 IC50 ChEMBL
Q8WWL7 CCNB3 Homo sapiens Human PF02984 PF00134 8.3 IC50 ChEMBL
P49840 GSK3A Homo sapiens Human PF00069 7.6 IC50 ChEMBL
P49841 GSK3B Homo sapiens Human PF00069 7.6 IC50 ChEMBL
P35968 KDR Homo sapiens Human PF07679 PF00047 PF13895 PF22971 PF07714 PF21339 PF17988 PF22854 7.3 IC50 ChEMBL
P24385 CCND1 Homo sapiens Human PF02984 PF00134 6.9 IC50 ChEMBL
P21802 FGFR2 Homo sapiens Human PF07679 PF13927 PF07714 6.7 IC50 ChEMBL;BindingDB
P09619 PDGFRB Homo sapiens Human PF00047 PF13927 PF25305 PF07714 6.5 IC50 BindingDB
P48729 CSNK1A1 Homo sapiens Human PF00069 6.2 IC50 ChEMBL
P48730 CSNK1D Homo sapiens Human PF00069 6.2 IC50 ChEMBL
P49674 CSNK1E Homo sapiens Human PF00069 6.2 IC50 ChEMBL
P78368 CSNK1G2 Homo sapiens Human PF12605 PF00069 6.2 IC50 ChEMBL
Q9HCP0 CSNK1G1 Homo sapiens Human PF12605 PF00069 6.2 IC50 ChEMBL
P00533 EGFR Homo sapiens Human PF00757 PF14843 PF07714 PF01030 PF21314 Clinical TTD_MultiTarget TTD_MultiTarget