null

SMILES: NC(=O)c1ccc2N(CCCc2c1)c1cccc(CNCCC2=CCCCC2)c1

InChI Key: InChIKey=TWMQOWPVAYQCMJ-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50417593   

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))	BDBM50417593 (CHEMBL1642751) Show SMILES NC(=O)c1ccc2N(CCCc2c1)c1cccc(CNCCC2=CCCCC2)c1 |t:24| Show InChI InChI=1S/C25H31N3O/c26-25(29)22-11-12-24-21(17-22)9-5-15-28(24)23-10-4-8-20(16-23)18-27-14-13-19-6-2-1-3-7-19/h4,6,8,10-12,16-17,27H,1-3,5,7,9,13-15,18H2,(H2,26,29)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	50	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
Delta-type opioid receptor (Homo sapiens (Human))	BDBM50417593 (CHEMBL1642751) Show SMILES NC(=O)c1ccc2N(CCCc2c1)c1cccc(CNCCC2=CCCCC2)c1 |t:24| Show InChI InChI=1S/C25H31N3O/c26-25(29)22-11-12-24-21(17-22)9-5-15-28(24)23-10-4-8-20(16-23)18-27-14-13-19-6-2-1-3-7-19/h4,6,8,10-12,16-17,27H,1-3,5,7,9,13-15,18H2,(H2,26,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	200	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
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM50417593 (CHEMBL1642751) Show SMILES NC(=O)c1ccc2N(CCCc2c1)c1cccc(CNCCC2=CCCCC2)c1 |t:24| Show InChI InChI=1S/C25H31N3O/c26-25(29)22-11-12-24-21(17-22)9-5-15-28(24)23-10-4-8-20(16-23)18-27-14-13-19-6-2-1-3-7-19/h4,6,8,10-12,16-17,27H,1-3,5,7,9,13-15,18H2,(H2,26,29)	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