Compile Data Set for Download or QSAR

Found 24 hits Enz. Inhib. hit(s) with all data for entry = 50001639   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM21015 ((2S)-2-{2-[(2R)-2-[(2S)-2-amino-3-(4-hydroxyphenyl...) Show SMILES C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N(C)[C@@H](Cc1ccccc1)C(=O)NCCO Show InChI InChI=1S/C26H35N5O6/c1-17(30-25(36)21(27)14-19-8-10-20(33)11-9-19)24(35)29-16-23(34)31(2)22(26(37)28-12-13-32)15-18-6-4-3-5-7-18/h3-11,17,21-22,32-33H,12-16,27H2,1-2H3,(H,28,37)(H,29,35)(H,30,36)/t17-,21+,22+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Similars	PubMed	1.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Clinical Research Institute of Montreal Curated by ChEMBL					Assay Description Binding affinity against Opioid receptor mu 1 by displacement of radioligand [3H]-DAGO in rat brain membrane				J Med Chem 32: 698-703 (1989) BindingDB Entry DOI: 10.7270/Q29W0DGM
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Rattus norvegicus (rat))	BDBM50016861 (2-[2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-he...) Show SMILES CCCC[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCN)C(N)=O Show InChI InChI=1S/C29H42N6O5/c1-2-3-10-24(34-27(38)22(31)17-20-12-14-21(36)15-13-20)28(39)35-25(18-19-8-5-4-6-9-19)29(40)33-23(26(32)37)11-7-16-30/h4-6,8-9,12-15,22-25,36H,2-3,7,10-11,16-18,30-31H2,1H3,(H2,32,37)(H,33,40)(H,34,38)(H,35,39)/t22-,23-,24+,25-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.35	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Clinical Research Institute of Montreal Curated by ChEMBL					Assay Description Binding affinity against delta opioid receptor by displacement of radioligand [3H]-DSLET in rat brain membrane				J Med Chem 32: 698-703 (1989) BindingDB Entry DOI: 10.7270/Q29W0DGM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50016861 (2-[2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-he...) Show SMILES CCCC[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCN)C(N)=O Show InChI InChI=1S/C29H42N6O5/c1-2-3-10-24(34-27(38)22(31)17-20-12-14-21(36)15-13-20)28(39)35-25(18-19-8-5-4-6-9-19)29(40)33-23(26(32)37)11-7-16-30/h4-6,8-9,12-15,22-25,36H,2-3,7,10-11,16-18,30-31H2,1H3,(H2,32,37)(H,33,40)(H,34,38)(H,35,39)/t22-,23-,24+,25-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Clinical Research Institute of Montreal Curated by ChEMBL					Assay Description Binding affinity against mu opioid receptor by displacement of radioligand [3H]-DAGO in rat brain membrane				J Med Chem 32: 698-703 (1989) BindingDB Entry DOI: 10.7270/Q29W0DGM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50060070 ((S)-2-Amino-N-{(R)-1-[(S)-1-((S)-1-carbamoyl-2-phe...) Show SMILES C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O Show InChI InChI=1S/C30H35N5O5/c1-19(33-29(39)24(31)16-22-12-14-23(36)15-13-22)28(38)35-26(18-21-10-6-3-7-11-21)30(40)34-25(27(32)37)17-20-8-4-2-5-9-20/h2-15,19,24-26,36H,16-18,31H2,1H3,(H2,32,37)(H,33,39)(H,34,40)(H,35,38)/t19-,24+,25+,26+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Clinical Research Institute of Montreal Curated by ChEMBL					Assay Description Binding affinity against Opioid receptor mu 1 by displacement of radioligand [3H]-DAGO in rat brain membrane				J Med Chem 32: 698-703 (1989) BindingDB Entry DOI: 10.7270/Q29W0DGM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50016867 ((S)-6-Amino-2-((S)-2-{(R)-2-[(S)-2-amino-3-(4-hydr...) Show SMILES NCCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(N)=O Show InChI InChI=1S/C30H45N9O5/c31-15-5-4-9-23(26(33)41)37-29(44)25(18-19-7-2-1-3-8-19)39-28(43)24(10-6-16-36-30(34)35)38-27(42)22(32)17-20-11-13-21(40)14-12-20/h1-3,7-8,11-14,22-25,40H,4-6,9-10,15-18,31-32H2,(H2,33,41)(H,37,44)(H,38,42)(H,39,43)(H4,34,35,36)/t22-,23-,24+,25-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	PubMed	1.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Clinical Research Institute of Montreal Curated by ChEMBL					Assay Description Binding affinity against opioid receptor mu by displacement of radioligand [3H]-DAGO in rat brain membrane				J Med Chem 32: 698-703 (1989) BindingDB Entry DOI: 10.7270/Q29W0DGM
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Rattus norvegicus (rat))	BDBM50001465 ((S)-2-[(S)-2-(2-{2-[(S)-2-Amino-3-(4-hydroxy-pheny...) Show SMILES CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(O)=O Show InChI InChI=1S/C28H37N5O7/c1-17(2)12-23(28(39)40)33-27(38)22(14-18-6-4-3-5-7-18)32-25(36)16-30-24(35)15-31-26(37)21(29)13-19-8-10-20(34)11-9-19/h3-11,17,21-23,34H,12-16,29H2,1-2H3,(H,30,35)(H,31,37)(H,32,36)(H,33,38)(H,39,40)/t21-,22-,23-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	PubMed	2.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Clinical Research Institute of Montreal Curated by ChEMBL					Assay Description Binding affinity against Opioid receptor delta 1 by displacement of radioligand [3H]-DSLET in rat brain membrane				J Med Chem 32: 698-703 (1989) BindingDB Entry DOI: 10.7270/Q29W0DGM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50016868 (2-(2-{2-[2-Amino-3-(4-hydroxy-phenyl)-propionylami...) Show SMILES CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CCC)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(N)=O Show InChI InChI=1S/C29H41N5O5/c1-3-5-12-23(26(31)36)32-29(39)25(18-19-10-7-6-8-11-19)34-28(38)24(9-4-2)33-27(37)22(30)17-20-13-15-21(35)16-14-20/h6-8,10-11,13-16,22-25,35H,3-5,9,12,17-18,30H2,1-2H3,(H2,31,36)(H,32,39)(H,33,37)(H,34,38)/t22-,23-,24+,25-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	3.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Clinical Research Institute of Montreal Curated by ChEMBL					Assay Description Binding affinity against Opioid receptor mu 1 by displacement of radioligand [3H]DAGO in rat brain membrane				J Med Chem 32: 698-703 (1989) BindingDB Entry DOI: 10.7270/Q29W0DGM
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Rattus norvegicus (rat))	BDBM50016868 (2-(2-{2-[2-Amino-3-(4-hydroxy-phenyl)-propionylami...) Show SMILES CCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CCC)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(N)=O Show InChI InChI=1S/C29H41N5O5/c1-3-5-12-23(26(31)36)32-29(39)25(18-19-10-7-6-8-11-19)34-28(38)24(9-4-2)33-27(37)22(30)17-20-13-15-21(35)16-14-20/h6-8,10-11,13-16,22-25,35H,3-5,9,12,17-18,30H2,1-2H3,(H2,31,36)(H,32,39)(H,33,37)(H,34,38)/t22-,23-,24+,25-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	3.53	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Clinical Research Institute of Montreal Curated by ChEMBL					Assay Description Binding affinity against Opioid receptor delta 1 by displacement of radioligand [3H]-DSLET in rat brain membrane				J Med Chem 32: 698-703 (1989) BindingDB Entry DOI: 10.7270/Q29W0DGM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50016866 (2-amino-4-{1-[1-[1-amino-2-(4-hydroxyphenyl)ethylc...) Show SMILES NC(CCNC(=O)C(Cc1ccccc1)NC(=O)[C@@H](CCCNC(N)=N)NC(=O)C(N)Cc1ccc(O)cc1)C(O)=O Show InChI InChI=1S/C28H40N8O6/c29-20(27(41)42)12-14-33-25(39)23(16-17-5-2-1-3-6-17)36-26(40)22(7-4-13-34-28(31)32)35-24(38)21(30)15-18-8-10-19(37)11-9-18/h1-3,5-6,8-11,20-23,37H,4,7,12-16,29-30H2,(H,33,39)(H,35,38)(H,36,40)(H,41,42)(H4,31,32,34)/t20?,21?,22-,23?/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	5.80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Clinical Research Institute of Montreal Curated by ChEMBL					Assay Description Binding affinity against opioid receptor mu by displacement of radioligand [3H]-DAGO in rat brain membrane				J Med Chem 32: 698-703 (1989) BindingDB Entry DOI: 10.7270/Q29W0DGM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50001465 ((S)-2-[(S)-2-(2-{2-[(S)-2-Amino-3-(4-hydroxy-pheny...) Show SMILES CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(O)=O Show InChI InChI=1S/C28H37N5O7/c1-17(2)12-23(28(39)40)33-27(38)22(14-18-6-4-3-5-7-18)32-25(36)16-30-24(35)15-31-26(37)21(29)13-19-8-10-20(34)11-9-19/h3-11,17,21-23,34H,12-16,29H2,1-2H3,(H,30,35)(H,31,37)(H,32,36)(H,33,38)(H,39,40)/t21-,22-,23-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	PubMed	9.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Clinical Research Institute of Montreal Curated by ChEMBL					Assay Description Binding affinity against Opioid receptor mu 1 by displacement of radioligand [3H]-DAGO in rat brain membrane				J Med Chem 32: 698-703 (1989) BindingDB Entry DOI: 10.7270/Q29W0DGM
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Rattus norvegicus (rat))	BDBM50016859 (1N-[4-amino(imino)methylamino-1-carbamoylbutyl]-2-...) Show SMILES [#6]-[#6@@H](-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](-[#7])=O Show InChI InChI=1S/C42H59N13O7/c1-25(51-37(59)30(43)22-28-16-18-29(56)19-17-28)36(58)54-33(23-26-10-4-2-5-11-26)40(62)55-34(24-27-12-6-3-7-13-27)39(61)53-32(15-9-21-50-42(47)48)38(60)52-31(35(44)57)14-8-20-49-41(45)46/h2-7,10-13,16-19,25,30-34,56H,8-9,14-15,20-24,43H2,1H3,(H2,44,57)(H,51,59)(H,52,60)(H,53,61)(H,54,58)(H,55,62)(H4,45,46,49)(H4,47,48,50)/t25-,30+,31+,32+,33+,34+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	167	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Clinical Research Institute of Montreal Curated by ChEMBL					Assay Description Binding affinity against Opioid receptor delta 1 by displacement of radioligand [3H]-DSLET in rat brain membrane				J Med Chem 32: 698-703 (1989) BindingDB Entry DOI: 10.7270/Q29W0DGM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50016859 (1N-[4-amino(imino)methylamino-1-carbamoylbutyl]-2-...) Show SMILES [#6]-[#6@@H](-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](-[#7])=O Show InChI InChI=1S/C42H59N13O7/c1-25(51-37(59)30(43)22-28-16-18-29(56)19-17-28)36(58)54-33(23-26-10-4-2-5-11-26)40(62)55-34(24-27-12-6-3-7-13-27)39(61)53-32(15-9-21-50-42(47)48)38(60)52-31(35(44)57)14-8-20-49-41(45)46/h2-7,10-13,16-19,25,30-34,56H,8-9,14-15,20-24,43H2,1H3,(H2,44,57)(H,51,59)(H,52,60)(H,53,61)(H,54,58)(H,55,62)(H4,45,46,49)(H4,47,48,50)/t25-,30+,31+,32+,33+,34+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	167	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Clinical Research Institute of Montreal Curated by ChEMBL					Assay Description Binding affinity against Opioid receptor mu 1 by displacement of radioligand [3H]-DAGO in rat brain membrane				J Med Chem 32: 698-703 (1989) BindingDB Entry DOI: 10.7270/Q29W0DGM
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Rattus norvegicus (rat))	BDBM50060070 ((S)-2-Amino-N-{(R)-1-[(S)-1-((S)-1-carbamoyl-2-phe...) Show SMILES C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O Show InChI InChI=1S/C30H35N5O5/c1-19(33-29(39)24(31)16-22-12-14-23(36)15-13-22)28(38)35-26(18-21-10-6-3-7-11-21)30(40)34-25(27(32)37)17-20-8-4-2-5-9-20/h2-15,19,24-26,36H,16-18,31H2,1H3,(H2,32,37)(H,33,39)(H,34,40)(H,35,38)/t19-,24+,25+,26+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	626	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Clinical Research Institute of Montreal Curated by ChEMBL					Assay Description Binding affinity against Opioid receptor delta 1 by displacement of radioligand [3H]-DSLET in rat brain membrane				J Med Chem 32: 698-703 (1989) BindingDB Entry DOI: 10.7270/Q29W0DGM
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Rattus norvegicus (rat))	BDBM21015 ((2S)-2-{2-[(2R)-2-[(2S)-2-amino-3-(4-hydroxyphenyl...) Show SMILES C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N(C)[C@@H](Cc1ccccc1)C(=O)NCCO Show InChI InChI=1S/C26H35N5O6/c1-17(30-25(36)21(27)14-19-8-10-20(33)11-9-19)24(35)29-16-23(34)31(2)22(26(37)28-12-13-32)15-18-6-4-3-5-7-18/h3-11,17,21-22,32-33H,12-16,27H2,1-2H3,(H,28,37)(H,29,35)(H,30,36)/t17-,21+,22+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Similars	PubMed	1.28E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Clinical Research Institute of Montreal Curated by ChEMBL					Assay Description Binding affinity against Opioid receptor delta 1 by displacement of radioligand [3H]-DSLET in rat brain membrane				J Med Chem 32: 698-703 (1989) BindingDB Entry DOI: 10.7270/Q29W0DGM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50016865 (12-[2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-2...) Show SMILES [#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@H]-1-[#6]-[#6]-[#6]-[#7]-[#6](=O)-[#6]-[#6@@H](-[#7]-[#6](=O)-[#6@H](-[#6]-c2ccccc2)-[#7]-[#6]-1=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](-[#7])=O Show InChI InChI=1S/C39H58N14O8/c40-25(19-23-12-14-24(54)15-13-23)33(57)50-27-10-5-16-46-31(55)21-30(53-36(60)29(52-35(27)59)20-22-7-2-1-3-8-22)37(61)51-28(11-6-18-48-39(44)45)34(58)49-26(32(41)56)9-4-17-47-38(42)43/h1-3,7-8,12-15,25-30,54H,4-6,9-11,16-21,40H2,(H2,41,56)(H,46,55)(H,49,58)(H,50,57)(H,51,61)(H,52,59)(H,53,60)(H4,42,43,47)(H4,44,45,48)/t25-,26-,27-,28-,29-,30+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.88E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Clinical Research Institute of Montreal Curated by ChEMBL					Assay Description Binding affinity against mu opioid receptor by displacement of radioligand [3H]-DAGO in rat brain membrane				J Med Chem 32: 698-703 (1989) BindingDB Entry DOI: 10.7270/Q29W0DGM
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Rattus norvegicus (rat))	BDBM50016865 (12-[2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-2...) Show SMILES [#7]-[#6@@H](-[#6]-c1ccc(-[#8])cc1)-[#6](=O)-[#7]-[#6@H]-1-[#6]-[#6]-[#6]-[#7]-[#6](=O)-[#6]-[#6@@H](-[#7]-[#6](=O)-[#6@H](-[#6]-c2ccccc2)-[#7]-[#6]-1=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#6](-[#7])=O Show InChI InChI=1S/C39H58N14O8/c40-25(19-23-12-14-24(54)15-13-23)33(57)50-27-10-5-16-46-31(55)21-30(53-36(60)29(52-35(27)59)20-22-7-2-1-3-8-22)37(61)51-28(11-6-18-48-39(44)45)34(58)49-26(32(41)56)9-4-17-47-38(42)43/h1-3,7-8,12-15,25-30,54H,4-6,9-11,16-21,40H2,(H2,41,56)(H,46,55)(H,49,58)(H,50,57)(H,51,61)(H,52,59)(H,53,60)(H4,42,43,47)(H4,44,45,48)/t25-,26-,27-,28-,29-,30+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.88E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Clinical Research Institute of Montreal Curated by ChEMBL					Assay Description Binding affinity against delta opioid receptor by displacement of radioligand [3H]-DSLET in rat brain membrane				J Med Chem 32: 698-703 (1989) BindingDB Entry DOI: 10.7270/Q29W0DGM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50016862 (5-Amino-2-(2-{2-[2-amino-3-(4-hydroxy-phenyl)-prop...) Show SMILES CCC[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCN)C(N)=O Show InChI InChI=1S/C28H40N6O5/c1-2-7-23(33-26(37)21(30)16-19-11-13-20(35)14-12-19)27(38)34-24(17-18-8-4-3-5-9-18)28(39)32-22(25(31)36)10-6-15-29/h3-5,8-9,11-14,21-24,35H,2,6-7,10,15-17,29-30H2,1H3,(H2,31,36)(H,32,39)(H,33,37)(H,34,38)/t21-,22-,23+,24-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.20E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Clinical Research Institute of Montreal Curated by ChEMBL					Assay Description Binding affinity against mu opioid receptor by displacement of radioligand [3H]-DAGO in rat brain membrane				J Med Chem 32: 698-703 (1989) BindingDB Entry DOI: 10.7270/Q29W0DGM
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Rattus norvegicus (rat))	BDBM50016862 (5-Amino-2-(2-{2-[2-amino-3-(4-hydroxy-phenyl)-prop...) Show SMILES CCC[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCN)C(N)=O Show InChI InChI=1S/C28H40N6O5/c1-2-7-23(33-26(37)21(30)16-19-11-13-20(35)14-12-19)27(38)34-24(17-18-8-4-3-5-9-18)28(39)32-22(25(31)36)10-6-15-29/h3-5,8-9,11-14,21-24,35H,2,6-7,10,15-17,29-30H2,1H3,(H2,31,36)(H,32,39)(H,33,37)(H,34,38)/t21-,22-,23+,24-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.20E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Clinical Research Institute of Montreal Curated by ChEMBL					Assay Description Binding affinity against delta opioid receptor by displacement of radioligand [3H]-DSLET in rat brain membrane				J Med Chem 32: 698-703 (1989) BindingDB Entry DOI: 10.7270/Q29W0DGM
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Rattus norvegicus (rat))	BDBM50016869 (12-[2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-2...) Show SMILES N[C@H](C(=O)N[C@H]1CCCNC(=O)C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC1=O)C(N)=O)c1ccc(O)cc1 Show InChI InChI=1S/C26H32N6O6/c27-22(16-8-10-17(33)11-9-16)26(38)30-18-7-4-12-29-21(34)14-19(23(28)35)31-25(37)20(32-24(18)36)13-15-5-2-1-3-6-15/h1-3,5-6,8-11,18-20,22,33H,4,7,12-14,27H2,(H2,28,35)(H,29,34)(H,30,38)(H,31,37)(H,32,36)/t18-,19+,20-,22-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.22E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Clinical Research Institute of Montreal Curated by ChEMBL					Assay Description Binding affinity against opioid receptor delta by displacement of radioligand [3H]-DSLET in rat brain membrane				J Med Chem 32: 698-703 (1989) BindingDB Entry DOI: 10.7270/Q29W0DGM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50016869 (12-[2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-2...) Show SMILES N[C@H](C(=O)N[C@H]1CCCNC(=O)C[C@@H](NC(=O)[C@H](Cc2ccccc2)NC1=O)C(N)=O)c1ccc(O)cc1 Show InChI InChI=1S/C26H32N6O6/c27-22(16-8-10-17(33)11-9-16)26(38)30-18-7-4-12-29-21(34)14-19(23(28)35)31-25(37)20(32-24(18)36)13-15-5-2-1-3-6-15/h1-3,5-6,8-11,18-20,22,33H,4,7,12-14,27H2,(H2,28,35)(H,29,34)(H,30,38)(H,31,37)(H,32,36)/t18-,19+,20-,22-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.22E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Clinical Research Institute of Montreal Curated by ChEMBL					Assay Description Binding affinity against opioid receptor mu by displacement of radioligand [3H]-DAGO in rat brain membrane				J Med Chem 32: 698-703 (1989) BindingDB Entry DOI: 10.7270/Q29W0DGM
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Rattus norvegicus (rat))	BDBM86417 (5-amino-2-{1-[1-[1-amino-2-(4-hydroxyphenyl)ethylc...) Show SMILES [#7]-[#6]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccccc1)-[#7]-[#6](=O)-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-c1ccc(-[#8])cc1)-[#6](-[#7])=O Show InChI InChI=1S/C29H43N9O5/c30-14-4-8-22(25(32)40)36-28(43)24(17-18-6-2-1-3-7-18)38-27(42)23(9-5-15-35-29(33)34)37-26(41)21(31)16-19-10-12-20(39)13-11-19/h1-3,6-7,10-13,21-24,39H,4-5,8-9,14-17,30-31H2,(H2,32,40)(H,36,43)(H,37,41)(H,38,42)(H4,33,34,35)/t21-,22-,23+,24-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	9.29E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Clinical Research Institute of Montreal Curated by ChEMBL					Assay Description Binding affinity against opioid receptor delta by displacement of radioligand [3H]-DSLET in rat brain membrane				J Med Chem 32: 698-703 (1989) BindingDB Entry DOI: 10.7270/Q29W0DGM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM86417 (5-amino-2-{1-[1-[1-amino-2-(4-hydroxyphenyl)ethylc...) Show SMILES [#7]-[#6]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccccc1)-[#7]-[#6](=O)-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-c1ccc(-[#8])cc1)-[#6](-[#7])=O Show InChI InChI=1S/C29H43N9O5/c30-14-4-8-22(25(32)40)36-28(43)24(17-18-6-2-1-3-7-18)38-27(42)23(9-5-15-35-29(33)34)37-26(41)21(31)16-19-10-12-20(39)13-11-19/h1-3,6-7,10-13,21-24,39H,4-5,8-9,14-17,30-31H2,(H2,32,40)(H,36,43)(H,37,41)(H,38,42)(H4,33,34,35)/t21-,22-,23+,24-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	9.29E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Clinical Research Institute of Montreal Curated by ChEMBL					Assay Description Binding affinity against opioid receptor mu by displacement of radioligand [3H]-DAGO in rat brain membrane				J Med Chem 32: 698-703 (1989) BindingDB Entry DOI: 10.7270/Q29W0DGM
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Rattus norvegicus (rat))	BDBM50016866 (2-amino-4-{1-[1-[1-amino-2-(4-hydroxyphenyl)ethylc...) Show SMILES NC(CCNC(=O)C(Cc1ccccc1)NC(=O)[C@@H](CCCNC(N)=N)NC(=O)C(N)Cc1ccc(O)cc1)C(O)=O Show InChI InChI=1S/C28H40N8O6/c29-20(27(41)42)12-14-33-25(39)23(16-17-5-2-1-3-6-17)36-26(40)22(7-4-13-34-28(31)32)35-24(38)21(30)15-18-8-10-19(37)11-9-18/h1-3,5-6,8-11,20-23,37H,4,7,12-16,29-30H2,(H,33,39)(H,35,38)(H,36,40)(H,41,42)(H4,31,32,34)/t20?,21?,22-,23?/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.26E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Clinical Research Institute of Montreal Curated by ChEMBL					Assay Description Binding affinity against opioid receptor delta by displacement of radioligand [3H]-DSLET in rat brain membrane				J Med Chem 32: 698-703 (1989) BindingDB Entry DOI: 10.7270/Q29W0DGM
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Rattus norvegicus (rat))	BDBM50016867 ((S)-6-Amino-2-((S)-2-{(R)-2-[(S)-2-amino-3-(4-hydr...) Show SMILES NCCCC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(N)=O Show InChI InChI=1S/C30H45N9O5/c31-15-5-4-9-23(26(33)41)37-29(44)25(18-19-7-2-1-3-8-19)39-28(43)24(10-6-16-36-30(34)35)38-27(42)22(32)17-20-11-13-21(40)14-12-20/h1-3,7-8,11-14,22-25,40H,4-6,9-10,15-18,31-32H2,(H2,33,41)(H,37,44)(H,38,42)(H,39,43)(H4,34,35,36)/t22-,23-,24+,25-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	PubMed	1.92E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Clinical Research Institute of Montreal Curated by ChEMBL					Assay Description Binding affinity against opioid receptor delta by displacement of radioligand [3H]-DSLET in rat brain membrane				J Med Chem 32: 698-703 (1989) BindingDB Entry DOI: 10.7270/Q29W0DGM
					More data for this Ligand-Target Pair