Molecule Details
| InChIKey | PVXYYWORFYROCX-UHFFFAOYSA-N |
|---|---|
| Compound Name | MLL1-WDR5 blocker DDO-2117 |
| Canonical SMILES | Cc1c(F)c(N)cc(C(=O)Nc2cc(-c3ccc(NC(=O)CCCN)cc3)ccc2N2CCN(C)CC2)c1Cl |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 4 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 7.04 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
Target Activities (4)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P61964 | WDR5 | Homo sapiens | Human | PF25175 | 8.0 | IC50 | ChEMBL;BindingDB |
| Q03164 | KMT2A | Homo sapiens | Human | PF05965 PF05964 PF00628 PF00856 PF02008 PF13771 | 6.7 | IC50 | ChEMBL |
| Q15291 | RBBP5 | Homo sapiens | Human | PF00400 | 6.7 | IC50 | ChEMBL |
| Q9UBL3 | ASH2L | Homo sapiens | Human | PF21198 PF21257 PF00622 | 6.7 | IC50 | ChEMBL |