BDBM50140743 (3aR,7aR)-1-(1-Cyclooctyl-piperidin-4-yl)-3-ethyl-octahydro-benzoimidazol-2-one::CHEMBL26464

SMILES: CCN1[C@@H]2CCCC[C@H]2N(C2CCN(CC2)C2CCCCCCC2)C1=O

InChI Key: InChIKey=XXCKMSSYGIADQR-NHCUHLMSSA-N

Data: 2 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 2 hits for monomerid = 50140743   

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
Nociceptin receptor (Homo sapiens (Human))	BDBM50140743 ((3aR,7aR)-1-(1-Cyclooctyl-piperidin-4-yl)-3-ethyl-...) Show SMILES CCN1[C@@H]2CCCC[C@H]2N(C2CCN(CC2)C2CCCCCCC2)C1=O Show InChI InChI=1S/C22H39N3O/c1-2-24-20-12-8-9-13-21(20)25(22(24)26)19-14-16-23(17-15-19)18-10-6-4-3-5-7-11-18/h18-21H,2-17H2,1H3/t20-,21-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	111	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue Pharma L.P. Curated by ChEMBL					Assay Description Binding affinity towards Nociceptin/orphanin FQ (N/OFQ) receptor from recombinant HEK293 cell membranes was determined using binding assay				Bioorg Med Chem Lett 14: 1347-51 (2004) Article DOI: 10.1016/j.bmcl.2003.11.083 BindingDB Entry DOI: 10.7270/Q2QJ7HW5
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM50140743 ((3aR,7aR)-1-(1-Cyclooctyl-piperidin-4-yl)-3-ethyl-...) Show SMILES CCN1[C@@H]2CCCC[C@H]2N(C2CCN(CC2)C2CCCCCCC2)C1=O Show InChI InChI=1S/C22H39N3O/c1-2-24-20-12-8-9-13-21(20)25(22(24)26)19-14-16-23(17-15-19)18-10-6-4-3-5-7-11-18/h18-21H,2-17H2,1H3/t20-,21-/m1/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	909	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue Pharma L.P. Curated by ChEMBL					Assay Description Binding affinity towards opioid receptor mu 1 using [3H]- diprenophine as radioligand from membrane preparations of recombinant HEK293 cells				Bioorg Med Chem Lett 14: 1347-51 (2004) Article DOI: 10.1016/j.bmcl.2003.11.083 BindingDB Entry DOI: 10.7270/Q2QJ7HW5
					More data for this Ligand-Target Pair