BDBM50281771 CHEMBL173841::N-[2-(3,4-Dichloro-phenyl)-4-(4-ethoxy-4-phenyl-piperidin-1-yl)-butyl]-N-methyl-benzamide

SMILES: CCOC1(CCN(CCC(CN(C)C(=O)c2ccccc2)c2ccc(Cl)c(Cl)c2)CC1)c1ccccc1

InChI Key: InChIKey=XRYBFLWUJSWSOS-UHFFFAOYSA-N

Data: 1 KI

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 = 50281771   

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
Neurokinin 2 receptor (Rattus norvegicus (Rat))	BDBM50281771 (CHEMBL173841 | N-[2-(3,4-Dichloro-phenyl)-4-(4-eth...) Show SMILES CCOC1(CCN(CCC(CN(C)C(=O)c2ccccc2)c2ccc(Cl)c(Cl)c2)CC1)c1ccccc1 Show InChI InChI=1S/C31H36Cl2N2O2/c1-3-37-31(27-12-8-5-9-13-27)17-20-35(21-18-31)19-16-26(25-14-15-28(32)29(33)22-25)23-34(2)30(36)24-10-6-4-7-11-24/h4-15,22,26H,3,16-21,23H2,1-2H3	Reactome pathway UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	0.900	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of [125I]-NKA binding to neurokinin NK2 receptor from rat duodenum membranes				Bioorg Med Chem Lett 3: 925-930 (1993) Article DOI: 10.1016/S0960-894X(00)80694-0 BindingDB Entry DOI: 10.7270/Q2N29WW1
					More data for this Ligand-Target Pair