BDBM50304597 (R,S)-N-(2-Benzoyl-4-propanoylaminophenyl)-2-(4-methyl-piperazin-1-yl)-2-phenylacetamide::CHEMBL594909

SMILES: CCC(=O)Nc1ccc(NC(=O)C(N2CCN(C)CC2)c2ccccc2)c(c1)C(=O)c1ccccc1

InChI Key: InChIKey=BTWIQQGVXBEERP-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 = 50304597   

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))	BDBM50304597 ((R,S)-N-(2-Benzoyl-4-propanoylaminophenyl)-2-(4-me...) Show SMILES CCC(=O)Nc1ccc(NC(=O)C(N2CCN(C)CC2)c2ccccc2)c(c1)C(=O)c1ccccc1 Show InChI InChI=1S/C29H32N4O3/c1-3-26(34)30-23-14-15-25(24(20-23)28(35)22-12-8-5-9-13-22)31-29(36)27(21-10-6-4-7-11-21)33-18-16-32(2)17-19-33/h4-15,20,27H,3,16-19H2,1-2H3,(H,30,34)(H,31,36)	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	3.30E+3	n/a	n/a	n/a	n/a
Philipps-Universit£t Marburg Curated by ChEMBL					Assay Description Inhibition of ABCB1 overexpressed in human CCRF-CEM/VCR1000 cell assessed as inhibition of daunomycin efflux after 30 mins by FACS analysis				Bioorg Med Chem 17: 7690-7 (2009) Article DOI: 10.1016/j.bmc.2009.09.043 BindingDB Entry DOI: 10.7270/Q2319W02
					More data for this Ligand-Target Pair