null

SMILES: CC(C)CNCc1ccc(cc1)N1CCCc2cc(ccc12)C(N)=O

InChI Key: InChIKey=WSZXJGMRKVWQMQ-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50417580   

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
Mu-type opioid receptor (Homo sapiens (Human))	BDBM50417580 (CHEMBL1642738) Show SMILES CC(C)CNCc1ccc(cc1)N1CCCc2cc(ccc12)C(N)=O Show InChI InChI=1S/C21H27N3O/c1-15(2)13-23-14-16-5-8-19(9-6-16)24-11-3-4-17-12-18(21(22)25)7-10-20(17)24/h5-10,12,15,23H,3-4,11,13-14H2,1-2H3,(H2,22,25)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	631	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Antagonist activity at human mu opioid receptor expressed in CHO cells assessed as [35S]GTPgammaS binding by SPA				Bioorg Med Chem Lett 21: 670-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.010 BindingDB Entry DOI: 10.7270/Q2KD2051
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM50417580 (CHEMBL1642738) Show SMILES CC(C)CNCc1ccc(cc1)N1CCCc2cc(ccc12)C(N)=O Show InChI InChI=1S/C21H27N3O/c1-15(2)13-23-14-16-5-8-19(9-6-16)24-11-3-4-17-12-18(21(22)25)7-10-20(17)24/h5-10,12,15,23H,3-4,11,13-14H2,1-2H3,(H2,22,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.26E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Antagonist activity at human kappa opioid receptor expressed in CHO cells assessed as [35S]GTPgammaS binding by SPA				Bioorg Med Chem Lett 21: 670-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.010 BindingDB Entry DOI: 10.7270/Q2KD2051
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM50417580 (CHEMBL1642738) Show SMILES CC(C)CNCc1ccc(cc1)N1CCCc2cc(ccc12)C(N)=O Show InChI InChI=1S/C21H27N3O/c1-15(2)13-23-14-16-5-8-19(9-6-16)24-11-3-4-17-12-18(21(22)25)7-10-20(17)24/h5-10,12,15,23H,3-4,11,13-14H2,1-2H3,(H2,22,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	<3.98E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Antagonist activity at human delta opioid receptor expressed in CHO cells assessed as [35S]GTPgammaS binding by SPA				Bioorg Med Chem Lett 21: 670-6 (2011) Article DOI: 10.1016/j.bmcl.2010.12.010 BindingDB Entry DOI: 10.7270/Q2KD2051
					More data for this Ligand-Target Pair