null

SMILES: CCNC(=O)NC[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](N)Cc1c(C)cc(O)cc1C

InChI Key: InChIKey=AKFDHTVXZQKREB-UGKGYDQZSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50101631   

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
Delta-type opioid receptor (Homo sapiens (Human))	BDBM50101631 (1-{2-[2-Amino-3-(4-hydroxy-2,6-dimethyl-phenyl)-pr...) Show SMILES CCNC(=O)NC[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](N)Cc1c(C)cc(O)cc1C Show InChI InChI=1S/C24H32N4O3/c1-4-26-24(31)27-13-19-11-17-7-5-6-8-18(17)14-28(19)23(30)22(25)12-21-15(2)9-20(29)10-16(21)3/h5-10,19,22,29H,4,11-14,25H2,1-3H3,(H2,26,27,31)/t19-,22-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	n/a	5.70	n/a	n/a	n/a	n/a
AstraZeneca R&D Montreal Curated by ChEMBL					Assay Description Agonist potency using GTP-gamma [35S]- binding assay for delta-opioid receptor				J Med Chem 44: 2387-90 (2001) BindingDB Entry DOI: 10.7270/Q25B01RW
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM50101631 (1-{2-[2-Amino-3-(4-hydroxy-2,6-dimethyl-phenyl)-pr...) Show SMILES CCNC(=O)NC[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](N)Cc1c(C)cc(O)cc1C Show InChI InChI=1S/C24H32N4O3/c1-4-26-24(31)27-13-19-11-17-7-5-6-8-18(17)14-28(19)23(30)22(25)12-21-15(2)9-20(29)10-16(21)3/h5-10,19,22,29H,4,11-14,25H2,1-3H3,(H2,26,27,31)/t19-,22-/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	169	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca R&D Montreal Curated by ChEMBL					Assay Description Agonist potency using GTP-gamma [35S]- binding assay for mu-opioid receptor				J Med Chem 44: 2387-90 (2001) BindingDB Entry DOI: 10.7270/Q25B01RW
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM50101631 (1-{2-[2-Amino-3-(4-hydroxy-2,6-dimethyl-phenyl)-pr...) Show SMILES CCNC(=O)NC[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](N)Cc1c(C)cc(O)cc1C Show InChI InChI=1S/C24H32N4O3/c1-4-26-24(31)27-13-19-11-17-7-5-6-8-18(17)14-28(19)23(30)22(25)12-21-15(2)9-20(29)10-16(21)3/h5-10,19,22,29H,4,11-14,25H2,1-3H3,(H2,26,27,31)/t19-,22-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	321	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca R&D Montreal Curated by ChEMBL					Assay Description Agonist potency using GTP-gamma [35S]- binding assay for opioid receptor kappa 1				J Med Chem 44: 2387-90 (2001) BindingDB Entry DOI: 10.7270/Q25B01RW
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM50101631 (1-{2-[2-Amino-3-(4-hydroxy-2,6-dimethyl-phenyl)-pr...) Show SMILES CCNC(=O)NC[C@@H]1Cc2ccccc2CN1C(=O)[C@@H](N)Cc1c(C)cc(O)cc1C Show InChI InChI=1S/C24H32N4O3/c1-4-26-24(31)27-13-19-11-17-7-5-6-8-18(17)14-28(19)23(30)22(25)12-21-15(2)9-20(29)10-16(21)3/h5-10,19,22,29H,4,11-14,25H2,1-3H3,(H2,26,27,31)/t19-,22-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	0.990	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca R&D Montreal Curated by ChEMBL					Assay Description Binding affinity at cloned human delta-opioid receptor				J Med Chem 44: 2387-90 (2001) BindingDB Entry DOI: 10.7270/Q25B01RW
					More data for this Ligand-Target Pair