Molecule Details
InChIKeyWVRKQDZPZOUPNW-UHFFFAOYSA-N
Compound Name7-[2-[(6-oxo-4-propyl-1H-pyrimidin-2-yl)sulfanyl]acetyl]-1,3,4,5-tetrahydro-1-benzazepin-2-one
Canonical SMILESCCCc1cc(=O)[nH]c(SCC(=O)c2ccc3c(c2)CCCC(=O)N3)n1
Clinical Status Data-mined Candidate
Targets (Human+Pathogen)4
Pfam Stratification Homologous
Avg pChEMBL6.41
SourceChEMBL
2D Structure
2D structure
Activity Profile
Target Activities (4)
Target Gene Organism Category Pfam pChEMBL Type Source
P42330 AKR1C3 Homo sapiens Human PF00248 6.7 IC50 ChEMBL
P17516 AKR1C4 Homo sapiens Human PF00248 6.4 IC50 ChEMBL
Q04828 AKR1C1 Homo sapiens Human PF00248 6.3 IC50 ChEMBL
P52895 AKR1C2 Homo sapiens Human PF00248 6.1 IC50 ChEMBL