null

SMILES: Ic1ccc(NC(=O)Nc2ccc3C[C@@H]4[C@@H]5CCCC[C@]5(CCN4CC4CC4)c3c2)cc1

InChI Key: InChIKey=NPYVOXBQYYFMIU-VXQMPNGUSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50303602   

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))	BDBM50303602 (CHEMBL569725 | N-[17-(Cyclopropylmethyl)morphinan-...) Show SMILES Ic1ccc(NC(=O)Nc2ccc3C[C@@H]4[C@@H]5CCCC[C@]5(CCN4CC4CC4)c3c2)cc1 |r| Show InChI InChI=1S/C27H32IN3O/c28-20-7-10-21(11-8-20)29-26(32)30-22-9-6-19-15-25-23-3-1-2-12-27(23,24(19)16-22)13-14-31(25)17-18-4-5-18/h6-11,16,18,23,25H,1-5,12-15,17H2,(H2,29,30,32)/t23-,25+,27+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	12	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Displacement of [3H]U69593 from human kappa opioid receptor expressed in CHO cells				J Med Chem 53: 402-18 (2010) Article DOI: 10.1021/jm9013482 BindingDB Entry DOI: 10.7270/Q2668D84
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM50303602 (CHEMBL569725 | N-[17-(Cyclopropylmethyl)morphinan-...) Show SMILES Ic1ccc(NC(=O)Nc2ccc3C[C@@H]4[C@@H]5CCCC[C@]5(CCN4CC4CC4)c3c2)cc1 |r| Show InChI InChI=1S/C27H32IN3O/c28-20-7-10-21(11-8-20)29-26(32)30-22-9-6-19-15-25-23-3-1-2-12-27(23,24(19)16-22)13-14-31(25)17-18-4-5-18/h6-11,16,18,23,25H,1-5,12-15,17H2,(H2,29,30,32)/t23-,25+,27+/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	23	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Displacement of [3H]DAMGO from human mu opioid receptor expressed in CHO cells				J Med Chem 53: 402-18 (2010) Article DOI: 10.1021/jm9013482 BindingDB Entry DOI: 10.7270/Q2668D84
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM50303602 (CHEMBL569725 | N-[17-(Cyclopropylmethyl)morphinan-...) Show SMILES Ic1ccc(NC(=O)Nc2ccc3C[C@@H]4[C@@H]5CCCC[C@]5(CCN4CC4CC4)c3c2)cc1 |r| Show InChI InChI=1S/C27H32IN3O/c28-20-7-10-21(11-8-20)29-26(32)30-22-9-6-19-15-25-23-3-1-2-12-27(23,24(19)16-22)13-14-31(25)17-18-4-5-18/h6-11,16,18,23,25H,1-5,12-15,17H2,(H2,29,30,32)/t23-,25+,27+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	94	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Displacement of [3H]naltrindole from human delta opioid receptor expressed in CHO cells				J Med Chem 53: 402-18 (2010) Article DOI: 10.1021/jm9013482 BindingDB Entry DOI: 10.7270/Q2668D84
					More data for this Ligand-Target Pair