BRD-K41775742 (BRD-K41775742)
Overview
- pert_id
- BRD-K41775742
- Name
- BRD-K41775742
- Collection
- CHRM
- MOA
- Unknown
- Target(s)
- Unknown
- Indication(s)
- Unknown
- Phase
- Unknown
- Canonical SMILES
- C[C@H](CO)N1C[C@H](C)[C@@H](CN(C)Cc2ccc(cc2)C(=O)Nc3ccccc3N)Oc4c(NC(=O)C5CCCCC5)cccc4C1=O
- InChI key
- InChIKey=QDRBVCQGVAHXBS-JQASONJCSA-N
- InChI string
- InChI=1S/C37H47N5O5/c1-24-20-42(25(2)23-43)37(46)29-12-9-15-32(40-35(44)27-10-5-4-6-11-27)34(29)47-33(24)22-41(3)21-26-16-18-28(19-17-26)36(45)39-31-14-8-7-13-30(31)38/h7-9,12-19,24-25,27,33,43H,4-6,10-11,20-23,38H2,1-3H3,(H,39,45)(H,40,44)/t24-,25+,33+/m0/s1
- Molecular formula
- C37H47N5O5
- Molecular weight
- 641.8
External links
- PubChem
- 44202529
- SEP-L1000
- BRD-K41775742
Predicted MOAs
| MOA | Probability |
|---|---|
| topoisomerase inhibitor | 0.2753 |
| dopamine receptor antagonist | 0.2181 |
| adrenergic receptor antagonist | 0.1125 |
| CDK inhibitor | 0.0590 |
| mTOR inhibitor | 0.0383 |
| protein synthesis inhibitor | 0.0331 |
| HSP inhibitor | 0.0283 |
| PI3K inhibitor | 0.0276 |
| EGFR inhibitor | 0.0184 |
| tubulin polymerization inhibitor | 0.0177 |
Chemical structure
