Molecule Details
InChIKeyPHENCDSAYZNXRO-UHFFFAOYSA-N
Compound NameBenzo[e]pyrimido[5,4-b][1,4]diazepin-6(11H)-one, 21
Canonical SMILESCc1cc(Nc2ncc3c(n2)N(C)c2ccccc2C(=O)N3C)ccc1C(=O)N1CCN(C)CC1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)3
Pfam Stratification Homologous
Avg pChEMBL8.16
SourceBindingDB;ChEMBL
2D Structure
2D structure
Activity Profile
Target Activities (3)
Target Gene Organism Category Pfam pChEMBL Type Source
O14965 AURKA Homo sapiens Human PF00069 8.4 IC50 BindingDB
O60285 NUAK1 Homo sapiens Human PF00069 8.2 IC50 ChEMBL;BindingDB
Q96GD4 AURKB Homo sapiens Human PF00069 7.8 IC50 BindingDB