Molecule Details
| InChIKey | PROYMPSAMYSXNO-WENCNXQZSA-N |
|---|---|
| Compound Name | 1-[(2r,15r)-2-[(1-Amino-4-Fluoroisoquinolin-6-Yl)amino]-4,15,17-Trimethyl-3,12-Dioxo-13-Oxa-4,11-Diazatricyclo[14.2.2.1~6,10~]henicosa-1(18),6(21),7,9,16,19-Hexaen-7-Yl]cyclobutane-1-Carboxylic Acid |
| Canonical SMILES | Cc1cc2ccc1[C@@H](C)COC(=O)Nc1ccc(C3(C(=O)O)CCC3)c(c1)CN(C)C(=O)[C@@H]2Nc1ccc2c(N)ncc(F)c2c1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 4 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 7.98 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (4)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P08709 | F7 | Homo sapiens | Human | PF00008 PF14670 PF00594 PF00089 | 9.8 | Ki | ChEMBL;BindingDB |
| P13726 | F3 | Homo sapiens | Human | PF09294 PF01108 | 9.8 | Ki | ChEMBL |
| P04070 | PROC | Homo sapiens | Human | PF14670 PF00594 PF00089 | 6.1 | Ki | ChEMBL;BindingDB |
| P00742 | F10 | Homo sapiens | Human | PF00008 PF14670 PF00594 PF00089 | 6.1 | Ki | ChEMBL;BindingDB |