Molecule Details
| InChIKey | ORLGNFCLIXMMAV-UHFFFAOYSA-N |
|---|---|
| Compound Name | 4-[4-(1-Hydroxymethyl-cyclopropyl)-phenoxy]-thieno[2,3-c]pyridine-2-carboxylic acid methylamide |
| Canonical SMILES | CNC(=O)c1cc2c(Oc3ccc(C4(CO)CC4)cc3)cncc2s1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 7.33 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (3)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P16581 | SELE | Homo sapiens | Human | PF00008 PF00059 PF00084 | 7.5 | IC50 | ChEMBL;BindingDB |
| P05362 | ICAM1 | Homo sapiens | Human | PF21146 PF03921 PF13895 | 7.3 | IC50 | ChEMBL;BindingDB |
| P19320 | VCAM1 | Homo sapiens | Human | PF05790 PF07679 PF00047 PF13927 | 7.1 | IC50 | ChEMBL;BindingDB |