Molecule Details
| InChIKey | UOHKZMQXEJGUES-HJWRWDBZSA-N |
|---|---|
| Compound Name | 3-[[(Z)-4-[4-(4-fluorophenyl)piperazin-1-yl]-4-oxobut-2-enoyl]amino]benzamide |
| Canonical SMILES | NC(=O)c1cccc(NC(=O)/C=C\C(=O)N2CCN(c3ccc(F)cc3)CC2)c1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 4 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 6.23 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (4)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| Q460N3 | PARP15 | Homo sapiens | Human | PF01661 PF00644 | 6.3 | IC50 | ChEMBL;BindingDB |
| P09874 | PARP1 | Homo sapiens | Human | PF00533 PF21728 PF00644 PF02877 PF05406 PF00645 PF08063 | 6.2 | IC50 | ChEMBL;BindingDB |
| Q8N5Y8 | PARP16 | Homo sapiens | Human | PF18084 PF00644 | 6.2 | IC50 | ChEMBL;BindingDB |
| Q460N5 | PARP14 | Homo sapiens | Human | PF23084 PF23248 PF23249 PF23251 PF23252 PF23253 PF23254 PF01661 PF00644 PF23222 PF23245 PF23085 PF22005 | 6.2 | IC50 | ChEMBL;BindingDB |