Molecule Details
| InChIKey | FMZCXIHHKPGEAD-UHFFFAOYSA-N |
|---|---|
| Compound Name | 24-(Hydroxymethyl)-9-methyl-1,9,14-triazaheptacyclo[16.7.1.02,17.03,11.06,10.012,16.022,26]hexacosa-2(17),3(11),4,6(10),7,12(16),18,20,22(26)-nonaene-13,15-dione |
| Canonical SMILES | Cn1ccc2ccc3c(c4c(c5c6cccc7c6n(c35)CC(CO)C7)C(=O)NC4=O)c21 |
| Clinical Status | Clinical Multi-Target |
| Targets (Human+Pathogen) | 5 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 6.55 |
| Source | ChEMBL;BindingDB;TTD_MultiTarget |
2D Structure
Activity Profile
Target Activities (5)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P11802 | CDK4 | Homo sapiens | Human | PF00069 | 7.1 | IC50 | ChEMBL;BindingDB |
| P24385 | CCND1 | Homo sapiens | Human | PF02984 PF00134 | 7.1 | IC50 | ChEMBL |
| O96020 | CCNE2 | Homo sapiens | Human | PF02984 PF00134 | 6.2 | IC50 | ChEMBL |
| P24864 | CCNE1 | Homo sapiens | Human | PF02984 PF00134 | 6.2 | IC50 | ChEMBL |
| P24941 | CDK2 | Homo sapiens | Human | PF00069 | 6.2 | pIC50 | TTD_MultiTarget |