Compile Data Set for Download or QSAR

Found 24 hits Enz. Inhib. hit(s) with all data for entry = 50004991   

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
Delta-type opioid receptor (Rattus norvegicus (rat))	BDBM50031226 ((S)-3-[2-({(S)-2-[(S)-2-((S)-2-{(R)-2-[(S)-2-Amino...) Show SMILES CCCCN(CC(=O)N[C@@H](CC(O)=O)C(N)=O)C(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CCSC)NC(=O)[C@@H](N)Cc1ccc(O)cc1 Show InChI InChI=1S/C45H64N10O10S/c1-5-6-17-55(25-38(57)50-34(40(47)60)23-39(58)59)45(65)37(19-27(2)3)54-44(64)36(22-30-24-48-26-49-30)53-43(63)35(21-28-10-8-7-9-11-28)52-42(62)33(16-18-66-4)51-41(61)32(46)20-29-12-14-31(56)15-13-29/h7-15,24,26-27,32-37,56H,5-6,16-23,25,46H2,1-4H3,(H2,47,60)(H,48,49)(H,50,57)(H,51,61)(H,52,62)(H,53,63)(H,54,64)(H,58,59)/t32-,33+,34-,35-,36-,37-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	0.0400	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tohoku College of Pharmacy Curated by ChEMBL					Assay Description Inhibition of [3H]-DADLE binding to rat brain delta receptor				J Med Chem 38: 3995-9 (1995) BindingDB Entry DOI: 10.7270/Q2P849WG
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Rattus norvegicus (rat))	BDBM50031219 ((S)-3-[2-({(S)-2-[(S)-2-((S)-2-{(R)-2-[(S)-2-Amino...) Show SMILES CC[C@H](C)N(CC(=O)N[C@@H](CC(O)=O)C(N)=O)C(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CCSC)NC(=O)[C@@H](N)Cc1ccc(O)cc1 Show InChI InChI=1S/C45H64N10O10S/c1-6-27(4)55(24-38(57)50-34(40(47)60)22-39(58)59)45(65)37(18-26(2)3)54-44(64)36(21-30-23-48-25-49-30)53-43(63)35(20-28-10-8-7-9-11-28)52-42(62)33(16-17-66-5)51-41(61)32(46)19-29-12-14-31(56)15-13-29/h7-15,23,25-27,32-37,56H,6,16-22,24,46H2,1-5H3,(H2,47,60)(H,48,49)(H,50,57)(H,51,61)(H,52,62)(H,53,63)(H,54,64)(H,58,59)/t27-,32-,33+,34-,35-,36-,37-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	0.0900	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tohoku College of Pharmacy Curated by ChEMBL					Assay Description Inhibition of [3H]-DADLE binding to rat brain delta receptor				J Med Chem 38: 3995-9 (1995) BindingDB Entry DOI: 10.7270/Q2P849WG
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Rattus norvegicus (rat))	BDBM50009180 (3-(2-{2-[2-(2-{2-[2-Amino-3-(4-hydroxy-phenyl)-pro...) Show SMILES CSCC[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(O)=O)C(N)=O Show InChI InChI=1S/C44H62N10O10S2/c1-25(2)18-34(42(62)50-32(15-17-66-4)40(60)51-33(38(46)58)22-37(56)57)52-44(64)36(21-28-23-47-24-48-28)54-43(63)35(20-26-8-6-5-7-9-26)53-41(61)31(14-16-65-3)49-39(59)30(45)19-27-10-12-29(55)13-11-27/h5-13,23-25,30-36,55H,14-22,45H2,1-4H3,(H2,46,58)(H,47,48)(H,49,59)(H,50,62)(H,51,60)(H,52,64)(H,53,61)(H,54,63)(H,56,57)/t30-,31-,32-,33-,34-,35-,36-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	0.190	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tohoku College of Pharmacy Curated by ChEMBL					Assay Description Inhibition of [3H]-DADLE binding to rat brain delta receptor				J Med Chem 38: 3995-9 (1995) BindingDB Entry DOI: 10.7270/Q2P849WG
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Rattus norvegicus (rat))	BDBM50031222 ((S)-3-((S)-2-{(S)-2-[(S)-2-((S)-2-{(R)-2-[(S)-2-Am...) Show SMILES CSCC[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(O)=O)C(N)=O)C(C)(C)C Show InChI InChI=1S/C45H64N10O10S/c1-25(2)18-33(43(64)55-37(45(3,4)5)44(65)51-32(38(47)59)22-36(57)58)52-42(63)35(21-28-23-48-24-49-28)54-41(62)34(20-26-10-8-7-9-11-26)53-40(61)31(16-17-66-6)50-39(60)30(46)19-27-12-14-29(56)15-13-27/h7-15,23-25,30-35,37,56H,16-22,46H2,1-6H3,(H2,47,59)(H,48,49)(H,50,60)(H,51,65)(H,52,63)(H,53,61)(H,54,62)(H,55,64)(H,57,58)/t30-,31+,32-,33-,34-,35-,37+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	0.460	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tohoku College of Pharmacy Curated by ChEMBL					Assay Description Inhibition of [3H]-DADLE binding to rat brain delta receptor				J Med Chem 38: 3995-9 (1995) BindingDB Entry DOI: 10.7270/Q2P849WG
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Rattus norvegicus (rat))	BDBM50031218 ((S)-3-[2-({(S)-2-[(S)-2-((S)-2-{(R)-2-[(S)-2-Amino...) Show SMILES CSCC[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(=O)N(CC(C)C)CC(=O)N[C@@H](CC(O)=O)C(N)=O Show InChI InChI=1S/C45H64N10O10S/c1-26(2)17-37(45(65)55(23-27(3)4)24-38(57)50-34(40(47)60)21-39(58)59)54-44(64)36(20-30-22-48-25-49-30)53-43(63)35(19-28-9-7-6-8-10-28)52-42(62)33(15-16-66-5)51-41(61)32(46)18-29-11-13-31(56)14-12-29/h6-14,22,25-27,32-37,56H,15-21,23-24,46H2,1-5H3,(H2,47,60)(H,48,49)(H,50,57)(H,51,61)(H,52,62)(H,53,63)(H,54,64)(H,58,59)/t32-,33+,34-,35-,36-,37-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	0.850	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tohoku College of Pharmacy Curated by ChEMBL					Assay Description Inhibition of [3H]-DADLE binding to rat brain delta receptor				J Med Chem 38: 3995-9 (1995) BindingDB Entry DOI: 10.7270/Q2P849WG
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Rattus norvegicus (rat))	BDBM50031224 ((S)-3-((S)-2-{(S)-2-[(S)-2-((S)-2-{(R)-2-[(S)-2-Am...) Show SMILES CSCC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CCSC)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CC(O)=O)C(N)=O Show InChI InChI=1S/C41H56N10O10S2/c1-23(36(56)47-29(13-15-62-2)38(58)49-31(35(43)55)20-34(53)54)46-40(60)33(19-26-21-44-22-45-26)51-41(61)32(18-24-7-5-4-6-8-24)50-39(59)30(14-16-63-3)48-37(57)28(42)17-25-9-11-27(52)12-10-25/h4-12,21-23,28-33,52H,13-20,42H2,1-3H3,(H2,43,55)(H,44,45)(H,46,60)(H,47,56)(H,48,57)(H,49,58)(H,50,59)(H,51,61)(H,53,54)/t23-,28-,29-,30+,31-,32-,33-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.71	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tohoku College of Pharmacy Curated by ChEMBL					Assay Description Inhibition of [3H]-DADLE binding to rat brain delta receptor				J Med Chem 38: 3995-9 (1995) BindingDB Entry DOI: 10.7270/Q2P849WG
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Rattus norvegicus (rat))	BDBM50031225 ((S)-3-[2-({(S)-2-[(S)-2-((S)-2-{(R)-2-[(S)-2-Amino...) Show SMILES CCCCN(CC(=O)N[C@@H](CC(O)=O)C(N)=O)C(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC[C@@H](CCSC)NC(=O)[C@@H](N)Cc1ccc(O)cc1 Show InChI InChI=1S/C45H66N10O9S/c1-5-6-17-55(26-39(57)52-35(41(47)60)23-40(58)59)45(64)38(19-28(2)3)54-44(63)37(22-32-24-48-27-50-32)53-43(62)36(21-29-10-8-7-9-11-29)49-25-31(16-18-65-4)51-42(61)34(46)20-30-12-14-33(56)15-13-30/h7-15,24,27-28,31,34-38,49,56H,5-6,16-23,25-26,46H2,1-4H3,(H2,47,60)(H,48,50)(H,51,61)(H,52,57)(H,53,62)(H,54,63)(H,58,59)/t31-,34+,35+,36+,37+,38+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.89	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tohoku College of Pharmacy Curated by ChEMBL					Assay Description Inhibition of [3H]-DADLE binding to rat brain delta receptor				J Med Chem 38: 3995-9 (1995) BindingDB Entry DOI: 10.7270/Q2P849WG
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Rattus norvegicus (rat))	BDBM50031221 ((S)-3-[2-({(S)-2-[(S)-2-((S)-2-{(R)-2-[(S)-2-Amino...) Show SMILES CCCCN(CC(=O)N[C@@H](CC(O)=O)C(N)=O)C(=O)[C@@H](NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC[C@@H](CCSC)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(C)(C)C Show InChI InChI=1S/C45H66N10O9S/c1-6-7-18-55(26-37(57)52-34(40(47)60)23-38(58)59)44(64)39(45(2,3)4)54-43(63)36(22-31-24-48-27-50-31)53-42(62)35(21-28-11-9-8-10-12-28)49-25-30(17-19-65-5)51-41(61)33(46)20-29-13-15-32(56)16-14-29/h8-16,24,27,30,33-36,39,49,56H,6-7,17-23,25-26,46H2,1-5H3,(H2,47,60)(H,48,50)(H,51,61)(H,52,57)(H,53,62)(H,54,63)(H,58,59)/t30-,33+,34+,35+,36+,39-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.56	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tohoku College of Pharmacy Curated by ChEMBL					Assay Description Inhibition of [3H]-DADLE binding to rat brain delta receptor				J Med Chem 38: 3995-9 (1995) BindingDB Entry DOI: 10.7270/Q2P849WG
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Rattus norvegicus (rat))	BDBM50031220 (3-(2-{2-[2-(2-{2-[2-Amino-3-(4-hydroxy-phenyl)-pro...) Show SMILES CSCC[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(O)=O)C(N)=O)C(C)(C)C Show InChI InChI=1S/C44H62N10O10S2/c1-44(2,3)36(43(64)50-31(16-18-66-5)39(60)51-32(37(46)58)22-35(56)57)54-42(63)34(21-27-23-47-24-48-27)53-41(62)33(20-25-9-7-6-8-10-25)52-40(61)30(15-17-65-4)49-38(59)29(45)19-26-11-13-28(55)14-12-26/h6-14,23-24,29-34,36,55H,15-22,45H2,1-5H3,(H2,46,58)(H,47,48)(H,49,59)(H,50,64)(H,51,60)(H,52,61)(H,53,62)(H,54,63)(H,56,57)/t29-,30+,31-,32-,33-,34-,36+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	9.45	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tohoku College of Pharmacy Curated by ChEMBL					Assay Description Inhibition of [3H]-DADLE binding to rat brain delta receptor				J Med Chem 38: 3995-9 (1995) BindingDB Entry DOI: 10.7270/Q2P849WG
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Rattus norvegicus (rat))	BDBM50031223 ((S)-3-[2-({(S)-2-[(S)-2-((S)-2-{(R)-2-[(S)-2-Amino...) Show SMILES CCCCN(CC(=O)N[C@@H](CC(O)=O)C(N)=O)C(=O)[C@@H](NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CCSC)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(C)(C)C Show InChI InChI=1S/C45H64N10O10S/c1-6-7-18-55(25-36(57)50-33(39(47)60)23-37(58)59)44(65)38(45(2,3)4)54-43(64)35(22-29-24-48-26-49-29)53-42(63)34(21-27-11-9-8-10-12-27)52-41(62)32(17-19-66-5)51-40(61)31(46)20-28-13-15-30(56)16-14-28/h8-16,24,26,31-35,38,56H,6-7,17-23,25,46H2,1-5H3,(H2,47,60)(H,48,49)(H,50,57)(H,51,61)(H,52,62)(H,53,63)(H,54,64)(H,58,59)/t31-,32+,33-,34-,35-,38+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	12.4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tohoku College of Pharmacy Curated by ChEMBL					Assay Description Inhibition of [3H]-DADLE binding to rat brain delta receptor				J Med Chem 38: 3995-9 (1995) BindingDB Entry DOI: 10.7270/Q2P849WG
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50031218 ((S)-3-[2-({(S)-2-[(S)-2-((S)-2-{(R)-2-[(S)-2-Amino...) Show SMILES CSCC[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(=O)N(CC(C)C)CC(=O)N[C@@H](CC(O)=O)C(N)=O Show InChI InChI=1S/C45H64N10O10S/c1-26(2)17-37(45(65)55(23-27(3)4)24-38(57)50-34(40(47)60)21-39(58)59)54-44(64)36(20-30-22-48-25-49-30)53-43(63)35(19-28-9-7-6-8-10-28)52-42(62)33(15-16-66-5)51-41(61)32(46)18-29-11-13-31(56)14-12-29/h6-14,22,25-27,32-37,56H,15-21,23-24,46H2,1-5H3,(H2,47,60)(H,48,49)(H,50,57)(H,51,61)(H,52,62)(H,53,63)(H,54,64)(H,58,59)/t32-,33+,34-,35-,36-,37-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	58	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tohoku College of Pharmacy Curated by ChEMBL					Assay Description Inhibition of [3H]-DAGO binding to rat brain Opioid receptor mu 1				J Med Chem 38: 3995-9 (1995) BindingDB Entry DOI: 10.7270/Q2P849WG
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50031224 ((S)-3-((S)-2-{(S)-2-[(S)-2-((S)-2-{(R)-2-[(S)-2-Am...) Show SMILES CSCC[C@H](NC(=O)[C@H](C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CCSC)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CC(O)=O)C(N)=O Show InChI InChI=1S/C41H56N10O10S2/c1-23(36(56)47-29(13-15-62-2)38(58)49-31(35(43)55)20-34(53)54)46-40(60)33(19-26-21-44-22-45-26)51-41(61)32(18-24-7-5-4-6-8-24)50-39(59)30(14-16-63-3)48-37(57)28(42)17-25-9-11-27(52)12-10-25/h4-12,21-23,28-33,52H,13-20,42H2,1-3H3,(H2,43,55)(H,44,45)(H,46,60)(H,47,56)(H,48,57)(H,49,58)(H,50,59)(H,51,61)(H,53,54)/t23-,28-,29-,30+,31-,32-,33-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	133	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tohoku College of Pharmacy Curated by ChEMBL					Assay Description Inhibition of [3H]-DAGO binding to rat brain Opioid receptor mu 1				J Med Chem 38: 3995-9 (1995) BindingDB Entry DOI: 10.7270/Q2P849WG
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50031225 ((S)-3-[2-({(S)-2-[(S)-2-((S)-2-{(R)-2-[(S)-2-Amino...) Show SMILES CCCCN(CC(=O)N[C@@H](CC(O)=O)C(N)=O)C(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC[C@@H](CCSC)NC(=O)[C@@H](N)Cc1ccc(O)cc1 Show InChI InChI=1S/C45H66N10O9S/c1-5-6-17-55(26-39(57)52-35(41(47)60)23-40(58)59)45(64)38(19-28(2)3)54-44(63)37(22-32-24-48-27-50-32)53-43(62)36(21-29-10-8-7-9-11-29)49-25-31(16-18-65-4)51-42(61)34(46)20-30-12-14-33(56)15-13-30/h7-15,24,27-28,31,34-38,49,56H,5-6,16-23,25-26,46H2,1-4H3,(H2,47,60)(H,48,50)(H,51,61)(H,52,57)(H,53,62)(H,54,63)(H,58,59)/t31-,34+,35+,36+,37+,38+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	143	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tohoku College of Pharmacy Curated by ChEMBL					Assay Description Inhibition of [3H]-DAGO binding to rat brain Opioid receptor mu 1				J Med Chem 38: 3995-9 (1995) BindingDB Entry DOI: 10.7270/Q2P849WG
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50031223 ((S)-3-[2-({(S)-2-[(S)-2-((S)-2-{(R)-2-[(S)-2-Amino...) Show SMILES CCCCN(CC(=O)N[C@@H](CC(O)=O)C(N)=O)C(=O)[C@@H](NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CCSC)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(C)(C)C Show InChI InChI=1S/C45H64N10O10S/c1-6-7-18-55(25-36(57)50-33(39(47)60)23-37(58)59)44(65)38(45(2,3)4)54-43(64)35(22-29-24-48-26-49-29)53-42(63)34(21-27-11-9-8-10-12-27)52-41(62)32(17-19-66-5)51-40(61)31(46)20-28-13-15-30(56)16-14-28/h8-16,24,26,31-35,38,56H,6-7,17-23,25,46H2,1-5H3,(H2,47,60)(H,48,49)(H,50,57)(H,51,61)(H,52,62)(H,53,63)(H,54,64)(H,58,59)/t31-,32+,33-,34-,35-,38+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	152	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tohoku College of Pharmacy Curated by ChEMBL					Assay Description Inhibition of [3H]-DAGO binding to rat brain Opioid receptor mu 1				J Med Chem 38: 3995-9 (1995) BindingDB Entry DOI: 10.7270/Q2P849WG
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50031221 ((S)-3-[2-({(S)-2-[(S)-2-((S)-2-{(R)-2-[(S)-2-Amino...) Show SMILES CCCCN(CC(=O)N[C@@H](CC(O)=O)C(N)=O)C(=O)[C@@H](NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC[C@@H](CCSC)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(C)(C)C Show InChI InChI=1S/C45H66N10O9S/c1-6-7-18-55(26-37(57)52-34(40(47)60)23-38(58)59)44(64)39(45(2,3)4)54-43(63)36(22-31-24-48-27-50-31)53-42(62)35(21-28-11-9-8-10-12-28)49-25-30(17-19-65-5)51-41(61)33(46)20-29-13-15-32(56)16-14-29/h8-16,24,27,30,33-36,39,49,56H,6-7,17-23,25-26,46H2,1-5H3,(H2,47,60)(H,48,50)(H,51,61)(H,52,57)(H,53,62)(H,54,63)(H,58,59)/t30-,33+,34+,35+,36+,39-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	157	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tohoku College of Pharmacy Curated by ChEMBL					Assay Description Inhibition of [3H]-DAGO binding to rat brain Opioid receptor mu 1				J Med Chem 38: 3995-9 (1995) BindingDB Entry DOI: 10.7270/Q2P849WG
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50009180 (3-(2-{2-[2-(2-{2-[2-Amino-3-(4-hydroxy-phenyl)-pro...) Show SMILES CSCC[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(O)=O)C(N)=O Show InChI InChI=1S/C44H62N10O10S2/c1-25(2)18-34(42(62)50-32(15-17-66-4)40(60)51-33(38(46)58)22-37(56)57)52-44(64)36(21-28-23-47-24-48-28)54-43(63)35(20-26-8-6-5-7-9-26)53-41(61)31(14-16-65-3)49-39(59)30(45)19-27-10-12-29(55)13-11-27/h5-13,23-25,30-36,55H,14-22,45H2,1-4H3,(H2,46,58)(H,47,48)(H,49,59)(H,50,62)(H,51,60)(H,52,64)(H,53,61)(H,54,63)(H,56,57)/t30-,31-,32-,33-,34-,35-,36-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	219	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tohoku College of Pharmacy Curated by ChEMBL					Assay Description Inhibition of [3H]-DAGO binding to rat brain Opioid receptor mu 1				J Med Chem 38: 3995-9 (1995) BindingDB Entry DOI: 10.7270/Q2P849WG
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50031222 ((S)-3-((S)-2-{(S)-2-[(S)-2-((S)-2-{(R)-2-[(S)-2-Am...) Show SMILES CSCC[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CC(O)=O)C(N)=O)C(C)(C)C Show InChI InChI=1S/C45H64N10O10S/c1-25(2)18-33(43(64)55-37(45(3,4)5)44(65)51-32(38(47)59)22-36(57)58)52-42(63)35(21-28-23-48-24-49-28)54-41(62)34(20-26-10-8-7-9-11-26)53-40(61)31(16-17-66-6)50-39(60)30(46)19-27-12-14-29(56)15-13-27/h7-15,23-25,30-35,37,56H,16-22,46H2,1-6H3,(H2,47,59)(H,48,49)(H,50,60)(H,51,65)(H,52,63)(H,53,61)(H,54,62)(H,55,64)(H,57,58)/t30-,31+,32-,33-,34-,35-,37+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	271	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tohoku College of Pharmacy Curated by ChEMBL					Assay Description Inhibition of [3H]-DAGO binding to rat brain Opioid receptor mu 1				J Med Chem 38: 3995-9 (1995) BindingDB Entry DOI: 10.7270/Q2P849WG
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50031220 (3-(2-{2-[2-(2-{2-[2-Amino-3-(4-hydroxy-phenyl)-pro...) Show SMILES CSCC[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](C(=O)N[C@@H](CCSC)C(=O)N[C@@H](CC(O)=O)C(N)=O)C(C)(C)C Show InChI InChI=1S/C44H62N10O10S2/c1-44(2,3)36(43(64)50-31(16-18-66-5)39(60)51-32(37(46)58)22-35(56)57)54-42(63)34(21-27-23-47-24-48-27)53-41(62)33(20-25-9-7-6-8-10-25)52-40(61)30(15-17-65-4)49-38(59)29(45)19-26-11-13-28(55)14-12-26/h6-14,23-24,29-34,36,55H,15-22,45H2,1-5H3,(H2,46,58)(H,47,48)(H,49,59)(H,50,64)(H,51,60)(H,52,61)(H,53,62)(H,54,63)(H,56,57)/t29-,30+,31-,32-,33-,34-,36+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	382	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tohoku College of Pharmacy Curated by ChEMBL					Assay Description Inhibition of [3H]-DAGO binding to rat brain Opioid receptor mu 1				J Med Chem 38: 3995-9 (1995) BindingDB Entry DOI: 10.7270/Q2P849WG
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50031219 ((S)-3-[2-({(S)-2-[(S)-2-((S)-2-{(R)-2-[(S)-2-Amino...) Show SMILES CC[C@H](C)N(CC(=O)N[C@@H](CC(O)=O)C(N)=O)C(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CCSC)NC(=O)[C@@H](N)Cc1ccc(O)cc1 Show InChI InChI=1S/C45H64N10O10S/c1-6-27(4)55(24-38(57)50-34(40(47)60)22-39(58)59)45(65)37(18-26(2)3)54-44(64)36(21-30-23-48-25-49-30)53-43(63)35(20-28-10-8-7-9-11-28)52-42(62)33(16-17-66-5)51-41(61)32(46)19-29-12-14-31(56)15-13-29/h7-15,23,25-27,32-37,56H,6,16-22,24,46H2,1-5H3,(H2,47,60)(H,48,49)(H,50,57)(H,51,61)(H,52,62)(H,53,63)(H,54,64)(H,58,59)/t27-,32-,33+,34-,35-,36-,37-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	798	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tohoku College of Pharmacy Curated by ChEMBL					Assay Description Inhibition of [3H]-DAGO binding to rat brain Opioid receptor mu 1				J Med Chem 38: 3995-9 (1995) BindingDB Entry DOI: 10.7270/Q2P849WG
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50031226 ((S)-3-[2-({(S)-2-[(S)-2-((S)-2-{(R)-2-[(S)-2-Amino...) Show SMILES CCCCN(CC(=O)N[C@@H](CC(O)=O)C(N)=O)C(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CCSC)NC(=O)[C@@H](N)Cc1ccc(O)cc1 Show InChI InChI=1S/C45H64N10O10S/c1-5-6-17-55(25-38(57)50-34(40(47)60)23-39(58)59)45(65)37(19-27(2)3)54-44(64)36(22-30-24-48-26-49-30)53-43(63)35(21-28-10-8-7-9-11-28)52-42(62)33(16-18-66-4)51-41(61)32(46)20-29-12-14-31(56)15-13-29/h7-15,24,26-27,32-37,56H,5-6,16-23,25,46H2,1-4H3,(H2,47,60)(H,48,49)(H,50,57)(H,51,61)(H,52,62)(H,53,63)(H,54,64)(H,58,59)/t32-,33+,34-,35-,36-,37-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	820	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tohoku College of Pharmacy Curated by ChEMBL					Assay Description Inhibition of [3H]-DAGO binding to rat brain Opioid receptor mu 1				J Med Chem 38: 3995-9 (1995) BindingDB Entry DOI: 10.7270/Q2P849WG
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50031219 ((S)-3-[2-({(S)-2-[(S)-2-((S)-2-{(R)-2-[(S)-2-Amino...) Show SMILES CC[C@H](C)N(CC(=O)N[C@@H](CC(O)=O)C(N)=O)C(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CCSC)NC(=O)[C@@H](N)Cc1ccc(O)cc1 Show InChI InChI=1S/C45H64N10O10S/c1-6-27(4)55(24-38(57)50-34(40(47)60)22-39(58)59)45(65)37(18-26(2)3)54-44(64)36(21-30-23-48-25-49-30)53-43(63)35(20-28-10-8-7-9-11-28)52-42(62)33(16-17-66-5)51-41(61)32(46)19-29-12-14-31(56)15-13-29/h7-15,23,25-27,32-37,56H,6,16-22,24,46H2,1-5H3,(H2,47,60)(H,48,49)(H,50,57)(H,51,61)(H,52,62)(H,53,63)(H,54,64)(H,58,59)/t27-,32-,33+,34-,35-,36-,37-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	856	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tohoku College of Pharmacy Curated by ChEMBL					Assay Description Inhibition of [3H]-DAGO binding to rat brain Opioid receptor mu 1				J Med Chem 38: 3995-9 (1995) BindingDB Entry DOI: 10.7270/Q2P849WG
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Rattus norvegicus (rat))	BDBM50031219 ((S)-3-[2-({(S)-2-[(S)-2-((S)-2-{(R)-2-[(S)-2-Amino...) Show SMILES CC[C@H](C)N(CC(=O)N[C@@H](CC(O)=O)C(N)=O)C(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](CCSC)NC(=O)[C@@H](N)Cc1ccc(O)cc1 Show InChI InChI=1S/C45H64N10O10S/c1-6-27(4)55(24-38(57)50-34(40(47)60)22-39(58)59)45(65)37(18-26(2)3)54-44(64)36(21-30-23-48-25-49-30)53-43(63)35(20-28-10-8-7-9-11-28)52-42(62)33(16-17-66-5)51-41(61)32(46)19-29-12-14-31(56)15-13-29/h7-15,23,25-27,32-37,56H,6,16-22,24,46H2,1-5H3,(H2,47,60)(H,48,49)(H,50,57)(H,51,61)(H,52,62)(H,53,63)(H,54,64)(H,58,59)/t27-,32-,33+,34-,35-,36-,37-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	856	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tohoku College of Pharmacy Curated by ChEMBL					Assay Description Inhibition of [3H]-DADLE binding to rat brain delta receptor				J Med Chem 38: 3995-9 (1995) BindingDB Entry DOI: 10.7270/Q2P849WG
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Rattus norvegicus (rat))	BDBM50031227 (1-(1-{(S)-2-[(S)-2-Amino-3-(4-hydroxy-phenyl)-prop...) Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(O)=O Show InChI InChI=1S/C25H36N4O6/c1-3-15(2)21(27-22(31)18(26)14-16-8-10-17(30)11-9-16)24(33)28-12-4-6-19(28)23(32)29-13-5-7-20(29)25(34)35/h8-11,15,18-21,30H,3-7,12-14,26H2,1-2H3,(H,27,31)(H,34,35)/t15-,18-,19-,20-,21-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	9.92E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tohoku College of Pharmacy Curated by ChEMBL					Assay Description Inhibition of [3H]-DADLE binding to rat brain delta receptor				J Med Chem 38: 3995-9 (1995) BindingDB Entry DOI: 10.7270/Q2P849WG
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50031227 (1-(1-{(S)-2-[(S)-2-Amino-3-(4-hydroxy-phenyl)-prop...) Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(O)=O Show InChI InChI=1S/C25H36N4O6/c1-3-15(2)21(27-22(31)18(26)14-16-8-10-17(30)11-9-16)24(33)28-12-4-6-19(28)23(32)29-13-5-7-20(29)25(34)35/h8-11,15,18-21,30H,3-7,12-14,26H2,1-2H3,(H,27,31)(H,34,35)/t15-,18-,19-,20-,21-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	9.92E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Tohoku College of Pharmacy Curated by ChEMBL					Assay Description Inhibition of [3H]-DAGO binding to rat brain Opioid receptor mu 1				J Med Chem 38: 3995-9 (1995) BindingDB Entry DOI: 10.7270/Q2P849WG
					More data for this Ligand-Target Pair