BDBM50613746 CHEMBL5271581

SMILES CC(=O)O[C@@]12CO[C@@H]1C[C@H](O)[C@@]1(C)C(=O)[C@H](O)C3=C(C)[C@@H](OC(=O)[C@H](OC(=O)CCC(=O)NCCCC[C@H](NC(=O)CC[C@@H](NC(=O)[C@H](C)NC(=O)/C=C/c4ccc(F)cc4Cl)C(N)=O)C(=O)O)[C@@H](NC(=O)OC(C)(C)C)c4ccccc4)C[C@@](O)([C@@H](OC(=O)c4ccccc4)[C@H]21)C3(C)C

InChI Key InChIKey=ZMDKGABGPBZBQT-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50613746   

TargetCytochrome P450 2C8(Human)
Shenzhen Salubris Pharmaceuticals Co.

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50613746BDBM50613746(CHEMBL5271581)
Affinity DataIC50: 9.97E+3nMAssay Description:Inhibition of CYP2C8 in human liver microsomes using probe substrate in presence of NADPHMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/22/2024
Entry Details
PubMed