BDBM50615469 CHEMBL5285476

SMILES COc1ccc2c3c([nH]c2c1)C(CC(C)C)N1C(=O)C(CCC(=O)OC(C)(C)C)NC(=O)C1C3

InChI Key InChIKey=NXNRAECHCJZNRF-UHFFFAOYSA-N

Data  3 IC50

PDB links: 1 PDB ID matches this monomer.

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50615469   

LigandChemical structure of BindingDB Monomer ID 50615469BDBM50615469(CHEMBL5285476)
Affinity DataIC50: 1.25E+3nMAssay Description:Inhibition of BCRP (unknown origin) by Hoechst 33342 staining based assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/23/2024
Entry Details
PubMedPDB3D3D Structure (crystal)
TargetATP-dependent translocase ABCB1(Human)
University of Bonn

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50615469BDBM50615469(CHEMBL5285476)
Affinity DataIC50: 3.63E+3nMAssay Description:Inhibition of P-gp (unknown origin) expressed in dog MDCK-MDR1cells by calcein AM accumulation assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/23/2024
Entry Details
PubMed
TargetMultidrug resistance-associated protein 1(Human)
University of Bonn

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50615469BDBM50615469(CHEMBL5285476)
Affinity DataIC50: 2.08E+4nMAssay Description:Inhibition of MRP1 (unknown origin) by calcein AM assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/23/2024
Entry Details
PubMed