BDBM50374724 CHEMBL408993

SMILES: [#6]-[#8]-c1cc2-[#6]-[#6]-[#7](-[#6]-[#6]\[#6]=[#6]-3\[#6]-[#6]-[#6]-[#6]-[#6]-3)-[#6]-c2cc1-[#8]-[#6]

InChI Key: InChIKey=NERQQHBBXMVPQY-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 = 50374724   

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))	BDBM50374724 (CHEMBL408993) Show SMILES [#6]-[#8]-c1cc2-[#6]-[#6]-[#7](-[#6]-[#6]\[#6]=[#6]-3\[#6]-[#6]-[#6]-[#6]-[#6]-3)-[#6]-c2cc1-[#8]-[#6] Show InChI InChI=1S/C20H29NO2/c1-22-19-13-17-10-12-21(15-18(17)14-20(19)23-2)11-6-9-16-7-4-3-5-8-16/h9,13-14H,3-8,10-12,15H2,1-2H3	PDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.52E+4	n/a	n/a	n/a	n/a
Universit£ degli Studi di Bari Curated by ChEMBL					Assay Description Inhibition of human Pgp mediated [3H]vinblastine transport in human Caco-2 cells				Bioorg Med Chem 16: 362-73 (2008) Article DOI: 10.1016/j.bmc.2007.09.039 BindingDB Entry DOI: 10.7270/Q2ST7QQS
					More data for this Ligand-Target Pair