BDBM50129520 CHEMBL69335::N-[2-(3,4-Dichloro-phenyl)-4-(4-phenyl-piperidin-1-yl)-butyl]-N-methyl-benzamide

SMILES: CN(CC(CCN1CCC(CC1)c1ccccc1)c1ccc(Cl)c(Cl)c1)C(=O)c1ccccc1

InChI Key: InChIKey=RBCQFSWWMJWSAU-UHFFFAOYSA-N

Data: 1 KI  1 IC50

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 2 hits for monomerid = 50129520   

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))	BDBM50129520 (CHEMBL69335 | N-[2-(3,4-Dichloro-phenyl)-4-(4-phen...) Show SMILES CN(CC(CCN1CCC(CC1)c1ccccc1)c1ccc(Cl)c(Cl)c1)C(=O)c1ccccc1 Show InChI InChI=1S/C29H32Cl2N2O/c1-32(29(34)24-10-6-3-7-11-24)21-26(25-12-13-27(30)28(31)20-25)16-19-33-17-14-23(15-18-33)22-8-4-2-5-9-22/h2-13,20,23,26H,14-19,21H2,1H3	Reactome pathway UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article	>100	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
Neurokinin 2 receptor (Homo sapiens (Human))	BDBM50129520 (CHEMBL69335 | N-[2-(3,4-Dichloro-phenyl)-4-(4-phen...) Show SMILES CN(CC(CCN1CCC(CC1)c1ccccc1)c1ccc(Cl)c(Cl)c1)C(=O)c1ccccc1 Show InChI InChI=1S/C29H32Cl2N2O/c1-32(29(34)24-10-6-3-7-11-24)21-26(25-12-13-27(30)28(31)20-25)16-19-33-17-14-23(15-18-33)22-8-4-2-5-9-22/h2-13,20,23,26H,14-19,21H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	<7	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Binding affinity for human tachykinin receptor 2 expressed in CHO cells using [125I]- NKA radioligand				Bioorg Med Chem Lett 13: 2211-5 (2003) BindingDB Entry DOI: 10.7270/Q2D799TN
					More data for this Ligand-Target Pair