BDBM50000283 1-[2-(3,4-Dichloro-phenyl)-acetyl]-6-pyrrolidin-1-ylmethyl-piperidin-3-one::CHEMBL344541

SMILES: Clc1ccc(CC(=O)N2CC(=O)CC[C@H]2CN2CCCC2)cc1Cl

InChI Key: InChIKey=JOEMGACWLKVQLY-AWEZNQCLSA-N

Data: 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 1 hit for monomerid = 50000283   

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
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM50000283 (1-[2-(3,4-Dichloro-phenyl)-acetyl]-6-pyrrolidin-1-...) Show SMILES Clc1ccc(CC(=O)N2CC(=O)CC[C@H]2CN2CCCC2)cc1Cl Show InChI InChI=1S/C18H22Cl2N2O2/c19-16-6-3-13(9-17(16)20)10-18(24)22-12-15(23)5-4-14(22)11-21-7-1-2-8-21/h3,6,9,14H,1-2,4-5,7-8,10-12H2/t14-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	390	n/a	n/a	n/a	n/a	n/a	n/a
Glaxo Group Research Ltd. Curated by ChEMBL					Assay Description Opioid receptor kappa 1 agonist potency was determined in vitro using rabbit vas deferens (LVD) preparation				J Med Chem 35: 490-501 (1992) BindingDB Entry DOI: 10.7270/Q2TQ60GV
					More data for this Ligand-Target Pair