BDBM50037586 2-[2-Oxo-2-((S)-2-pyrrolidin-1-ylmethyl-piperidin-1-yl)-ethyl]-6,7,8,9-tetrahydro-benzocyclohepten-5-one::CHEMBL326553

SMILES: O=C(Cc1ccc2c(CCCCC2=O)c1)N1CCCC[C@H]1CN1CCCC1

InChI Key: InChIKey=WKOBBCOVPVULHK-FQEVSTJZSA-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 = 50037586   

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 (Mus musculus (Mouse))	BDBM50037586 (2-[2-Oxo-2-((S)-2-pyrrolidin-1-ylmethyl-piperidin-...) Show SMILES O=C(Cc1ccc2c(CCCCC2=O)c1)N1CCCC[C@H]1CN1CCCC1 Show InChI InChI=1S/C23H32N2O2/c26-22-9-2-1-7-19-15-18(10-11-21(19)22)16-23(27)25-14-4-3-8-20(25)17-24-12-5-6-13-24/h10-11,15,20H,1-9,12-14,16-17H2/t20-/m0/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	5.44	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
SmithKline Beecham Farmaceutici S.p.A. Curated by ChEMBL					Assay Description Evaluated for the binding affinity at kappa receptor				J Med Chem 37: 3482-91 (1994) BindingDB Entry DOI: 10.7270/Q2W37VB6
					More data for this Ligand-Target Pair