Compile Data Set for Download or QSAR
Found 1 Enz. Inhib. hit(s) with Target = 'Substance-K receptor' and Ligand = 'BDBM50403919'
TargetSubstance-K receptor(Homo sapiens (Human))
Novartis Pharma AG

Curated by ChEMBL
LigandPNGBDBM50403919(CHEMBL2112211)
Show SMILES CN(C(=O)c1cc(cc(c1)C(F)(F)F)C(F)(F)F)c1cc(ccc1-c1ccc(C)cc1)C(=O)N[C@@H]1CCCCNC1=O
Show InChI InChI=1S/C30H27F6N3O3/c1-17-6-8-18(9-7-17)23-11-10-19(26(40)38-24-5-3-4-12-37-27(24)41)15-25(23)39(2)28(42)20-13-21(29(31,32)33)16-22(14-20)30(34,35)36/h6-11,13-16,24H,3-5,12H2,1-2H3,(H,37,41)(H,38,40)/t24-/m1/s1
Affinity DataIC50: 181nMAssay Description:Binding affinity of the compound was determined by measuring the inhibition of 125 I-NKA binding to transfected CHO-cells expressing human recombinan...More data for this Ligand-Target Pair