BDBM50032259 CHEMBL3352975

SMILES: COc1cc2CCN(Cc2cc1OC)C(=O)c1ccc(o1)-c1ccc(O)cc1

InChI Key: InChIKey=RVMCLYRTOLRSTD-UHFFFAOYSA-N

Data: 1 EC50

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 = 50032259   

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
P-glycoprotein 1 (Homo sapiens (Human))	BDBM50032259 (CHEMBL3352975) Show SMILES COc1cc2CCN(Cc2cc1OC)C(=O)c1ccc(o1)-c1ccc(O)cc1 Show InChI InChI=1S/C22H21NO5/c1-26-20-11-15-9-10-23(13-16(15)12-21(20)27-2)22(25)19-8-7-18(28-19)14-3-5-17(24)6-4-14/h3-8,11-12,24H,9-10,13H2,1-2H3	PDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	6.40E+3	n/a	n/a	n/a	n/a
Universit£ degli Studi di Bari"A. Moro" Curated by ChEMBL					Assay Description Inhibition of MDR1 (unknown origin) over-expressed in MDCK cells assessed as calcein accumulation incubated for 30 mins prior to Calcein-AM addition ...				J Med Chem 57: 9983-94 (2014) Article DOI: 10.1021/jm501640e BindingDB Entry DOI: 10.7270/Q2K9394N
					More data for this Ligand-Target Pair