BDBM50238969 CHEMBL4096764

SMILES: Cc1cc(C)c2n(CCCN(CCO)CCO)c3ccccc3c(=O)c2c1

InChI Key: InChIKey=OJXGDCVVEXNSPG-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50238969   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Multidrug resistance protein 1/Multidrug resistance associated protein 1 (Homo sapiens (Human))	BDBM50238969 (CHEMBL4096764) Show SMILES Cc1cc(C)c2n(CCCN(CCO)CCO)c3ccccc3c(=O)c2c1 Show InChI InChI=1S/C22H28N2O3/c1-16-14-17(2)21-19(15-16)22(27)18-6-3-4-7-20(18)24(21)9-5-8-23(10-12-25)11-13-26/h3-4,6-7,14-15,25-26H,5,8-13H2,1-2H3	PDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
SVKM's Dr. Bhanuben Nanavati College of Pharmacy Curated by ChEMBL					Assay Description Inhibition of ABCB1 in human MCF7/ADR cells assessed as potentiation of vinblastine-induced cytotoxicity by measuring vinblastine IC50 at IC10 after ...				Eur J Med Chem 130: 154-170 (2017) Article DOI: 10.1016/j.ejmech.2017.02.022 BindingDB Entry DOI: 10.7270/Q26D5W99
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