BDBM50338372 3-((R)-methylsulfinylmethyl)-2-phenyl-N-((S)-1-phenylpropyl)quinoline-4-carboxamide::CHEMBL1682942

SMILES: CC[C@H](NC(=O)c1c(C[S@@](C)=O)c(nc2ccccc12)-c1ccccc1)c1ccccc1

InChI Key: InChIKey=PWWDZABEDRJKJU-JPQMRUPTSA-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 = 50338372   

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
Neuromedin-K receptor (Homo sapiens (Human))	BDBM50338372 (3-((R)-methylsulfinylmethyl)-2-phenyl-N-((S)-1-phe...) Show SMILES CC[C@H](NC(=O)c1c(C[S@@](C)=O)c(nc2ccccc12)-c1ccccc1)c1ccccc1 |r| Show InChI InChI=1S/C27H26N2O2S/c1-3-23(19-12-6-4-7-13-19)29-27(30)25-21-16-10-11-17-24(21)28-26(22(25)18-32(2)31)20-14-8-5-9-15-20/h4-17,23H,3,18H2,1-2H3,(H,29,30)/t23-,32+/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.80	n/a	n/a	n/a	n/a
AstraZeneca Pharmaceuticals Curated by ChEMBL					Assay Description Antagonist activity at human NK3 receptor expressed in CHO cells assessed as inhibition of senktide-induced calcium flux by FLIPR assay				Bioorg Med Chem Lett 21: 1896-9 (2011) Article DOI: 10.1016/j.bmcl.2010.11.003 BindingDB Entry DOI: 10.7270/Q2XP7586
					More data for this Ligand-Target Pair