Molecule Details
| InChIKey | RDCQUWQHGNCDQF-UHFFFAOYSA-N |
|---|---|
| Compound Name | 2-(4-(4-(1,2-benzisothiazol-3-yl)-1-piperazinyl)-4-oxobutyl)-4(3H)-quinazolinone |
| Canonical SMILES | O=C(CCCc1nc2ccccc2c(=O)[nH]1)N1CCN(c2nsc3ccccc23)CC1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 6.41 |
| Source | BindingDB;ChEMBL |
2D Structure
Activity Profile
Target Activities (3)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| Q9UGN5 | PARP2 | Homo sapiens | Human | PF00644 PF02877 PF05406 | 6.5 | IC50 | ChEMBL;BindingDB |
| O95271 | TNKS | Homo sapiens | Human | PF00023 PF12796 PF00644 PF07647 | 6.4 | IC50 | ChEMBL;BindingDB |
| Q9H2K2 | TNKS2 | Homo sapiens | Human | PF00023 PF12796 PF13637 PF00644 PF07647 | 6.3 | IC50 | BindingDB |