Molecule Details
| InChIKey | JDZQHCQYJAHSCQ-UHFFFAOYSA-N |
|---|---|
| Compound Name | 2-[4-(2-hydroxypropan-2-yl)phenyl]-7-methyl-3H-pyrrolo[2,1-f][1,2,4]triazin-4-one |
| Canonical SMILES | Cc1ccc2c(=O)[nH]c(-c3ccc(C(C)(C)O)cc3)nn12 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 8.06 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (3)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| O95271 | TNKS | Homo sapiens | Human | PF00023 PF12796 PF00644 PF07647 | 9.1 | IC50 | ChEMBL;BindingDB |
| Q9H2K2 | TNKS2 | Homo sapiens | Human | PF00023 PF12796 PF13637 PF00644 PF07647 | 9.1 | IC50 | ChEMBL;BindingDB |
| P09874 | PARP1 | Homo sapiens | Human | PF00533 PF21728 PF00644 PF02877 PF05406 PF00645 PF08063 | 6.0 | IC50 | ChEMBL;BindingDB |