Molecule Details
| InChIKey | BTTCKSLDCMBUAH-DNQXCXABSA-N |
|---|---|
| Compound Name | 8-[[(3R,4R)-3-[(1,1-dioxothian-4-yl)methoxy]-1-methylpiperidin-4-yl]amino]-3-methyl-5-(5-methyl-3-pyridinyl)-1H-1,7-naphthyridin-2-one |
| Canonical SMILES | Cc1cncc(-c2cnc(N[C@@H]3CCN(C)C[C@H]3OCC3CCS(=O)(=O)CC3)c3[nH]c(=O)c(C)cc23)c1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 7 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 6.69 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (7)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P21675 | TAF1 | Homo sapiens | Human | PF00439 PF12157 PF09247 PF15288 | 7.3 | Ki | ChEMBL;BindingDB |
| Q9ULI0 | ATAD2B | Homo sapiens | Human | PF00004 PF17862 PF00439 | 7.2 | Kd | ChEMBL;BindingDB |
| Q8IZX4 | TAF1L | Homo sapiens | Human | PF00439 PF12157 PF09247 PF15288 | 6.9 | Ki | ChEMBL;BindingDB |
| Q6PL18 | ATAD2 | Homo sapiens | Human | PF00004 PF17862 PF00439 | 6.8 | IC50 | ChEMBL;BindingDB |
| O95696 | BRD1 | Homo sapiens | Human | PF00439 PF10513 PF13831 PF00855 PF13832 | 6.4 | Ki | ChEMBL;BindingDB |
| Q9BXF3 | CECR2 | Homo sapiens | Human | PF00439 | 6.1 | Ki | ChEMBL;BindingDB |
| Q9ULD4 | BRPF3 | Homo sapiens | Human | PF00439 PF10513 PF13831 PF00855 PF13832 | 6.1 | Ki | ChEMBL;BindingDB |