Compile Data Set for Download or QSAR

Found 34 hits Enz. Inhib. hit(s) with all data for entry = 50013441   

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))	BDBM50130611 (2-Amino-N-{4-[2-amino-3-(4-hydroxy-2,6-dimethyl-ph...) Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)NCCCCNC(=O)[C@H](N)Cc1c(C)cc(O)cc1C Show InChI InChI=1S/C26H38N4O4/c1-15-9-19(31)10-16(2)21(15)13-23(27)25(33)29-7-5-6-8-30-26(34)24(28)14-22-17(3)11-20(32)12-18(22)4/h9-12,23-24,31-32H,5-8,13-14,27-28H2,1-4H3,(H,29,33)(H,30,34)/t23-,24+	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.0400	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Binding affinity for Opioid receptor mu 1 using [3H]-DAGO in rat brain P2 synaptosomal preparation				J Med Chem 46: 3201-9 (2003) Article DOI: 10.1021/jm020459z BindingDB Entry DOI: 10.7270/Q28C9VMQ
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50130617 (2-Amino-N-{6-[2-amino-3-(4-hydroxy-2,6-dimethyl-ph...) Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)NCCCCCCNC(=O)[C@H](N)Cc1c(C)cc(O)cc1C Show InChI InChI=1S/C28H42N4O4/c1-17-11-21(33)12-18(2)23(17)15-25(29)27(35)31-9-7-5-6-8-10-32-28(36)26(30)16-24-19(3)13-22(34)14-20(24)4/h11-14,25-26,33-34H,5-10,15-16,29-30H2,1-4H3,(H,31,35)(H,32,36)/t25-,26+	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.0500	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Binding affinity for Opioid receptor mu 1 using [3H]-DAGO in rat brain P2 synaptosomal preparation				J Med Chem 46: 3201-9 (2003) Article DOI: 10.1021/jm020459z BindingDB Entry DOI: 10.7270/Q28C9VMQ
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50130619 (2-Amino-N-{8-[2-amino-3-(4-hydroxy-2,6-dimethyl-ph...) Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)NCCCCCCCCNC(=O)[C@H](N)Cc1c(C)cc(O)cc1C Show InChI InChI=1S/C30H46N4O4/c1-19-13-23(35)14-20(2)25(19)17-27(31)29(37)33-11-9-7-5-6-8-10-12-34-30(38)28(32)18-26-21(3)15-24(36)16-22(26)4/h13-16,27-28,35-36H,5-12,17-18,31-32H2,1-4H3,(H,33,37)(H,34,38)/t27-,28+	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.190	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Binding affinity for Opioid receptor mu 1 using [3H]-DAGO in rat brain P2 synaptosomal preparation				J Med Chem 46: 3201-9 (2003) Article DOI: 10.1021/jm020459z BindingDB Entry DOI: 10.7270/Q28C9VMQ
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50130613 (2-Amino-N-{4-[2-amino-3-(4-hydroxy-phenyl)-propion...) Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)NCCCCNC(=O)[C@H](N)Cc1ccc(O)cc1 Show InChI InChI=1S/C24H34N4O4/c1-15-11-19(30)12-16(2)20(15)14-22(26)24(32)28-10-4-3-9-27-23(31)21(25)13-17-5-7-18(29)8-6-17/h5-8,11-12,21-22,29-30H,3-4,9-10,13-14,25-26H2,1-2H3,(H,27,31)(H,28,32)/t21-,22+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.380	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Binding affinity for Opioid receptor mu 1 using [3H]-DAGO in rat brain P2 synaptosomal preparation				J Med Chem 46: 3201-9 (2003) Article DOI: 10.1021/jm020459z BindingDB Entry DOI: 10.7270/Q28C9VMQ
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50130612 (2-Amino-N-[4-(2-amino-3-phenyl-propionylamino)-but...) Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)NCCCCNC(=O)[C@H](N)Cc1ccccc1 Show InChI InChI=1S/C24H34N4O3/c1-16-12-19(29)13-17(2)20(16)15-22(26)24(31)28-11-7-6-10-27-23(30)21(25)14-18-8-4-3-5-9-18/h3-5,8-9,12-13,21-22,29H,6-7,10-11,14-15,25-26H2,1-2H3,(H,27,30)(H,28,31)/t21-,22+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	0.520	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Binding affinity for Opioid receptor mu 1 using [3H]-DAGO in rat brain P2 synaptosomal preparation				J Med Chem 46: 3201-9 (2003) Article DOI: 10.1021/jm020459z BindingDB Entry DOI: 10.7270/Q28C9VMQ
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50130614 (2-Amino-N-{2-[2-amino-3-(4-hydroxy-2,6-dimethyl-ph...) Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)NCCNC(=O)[C@H](N)Cc1c(C)cc(O)cc1C Show InChI InChI=1S/C24H34N4O4/c1-13-7-17(29)8-14(2)19(13)11-21(25)23(31)27-5-6-28-24(32)22(26)12-20-15(3)9-18(30)10-16(20)4/h7-10,21-22,29-30H,5-6,11-12,25-26H2,1-4H3,(H,27,31)(H,28,32)/t21-,22+	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Binding affinity for Opioid receptor mu 1 using [3H]-DAGO in rat brain P2 synaptosomal preparation				J Med Chem 46: 3201-9 (2003) Article DOI: 10.1021/jm020459z BindingDB Entry DOI: 10.7270/Q28C9VMQ
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Rattus norvegicus (rat))	BDBM50130619 (2-Amino-N-{8-[2-amino-3-(4-hydroxy-2,6-dimethyl-ph...) Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)NCCCCCCCCNC(=O)[C@H](N)Cc1c(C)cc(O)cc1C Show InChI InChI=1S/C30H46N4O4/c1-19-13-23(35)14-20(2)25(19)17-27(31)29(37)33-11-9-7-5-6-8-10-12-34-30(38)28(32)18-26-21(3)15-24(36)16-22(26)4/h13-16,27-28,35-36H,5-12,17-18,31-32H2,1-4H3,(H,33,37)(H,34,38)/t27-,28+	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	15	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Binding affinity for Opioid receptor delta 1 using [3H]-DPDPE in rat brain P2 synaptosomal preparation				J Med Chem 46: 3201-9 (2003) Article DOI: 10.1021/jm020459z BindingDB Entry DOI: 10.7270/Q28C9VMQ
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Rattus norvegicus (rat))	BDBM50130617 (2-Amino-N-{6-[2-amino-3-(4-hydroxy-2,6-dimethyl-ph...) Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)NCCCCCCNC(=O)[C@H](N)Cc1c(C)cc(O)cc1C Show InChI InChI=1S/C28H42N4O4/c1-17-11-21(33)12-18(2)23(17)15-25(29)27(35)31-9-7-5-6-8-10-32-28(36)26(30)16-24-19(3)13-22(34)14-20(24)4/h11-14,25-26,33-34H,5-10,15-16,29-30H2,1-4H3,(H,31,35)(H,32,36)/t25-,26+	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	46	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Binding affinity for Opioid receptor delta 1 using [3H]-DPDPE in rat brain P2 synaptosomal preparation				J Med Chem 46: 3201-9 (2003) Article DOI: 10.1021/jm020459z BindingDB Entry DOI: 10.7270/Q28C9VMQ
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Rattus norvegicus (rat))	BDBM50130611 (2-Amino-N-{4-[2-amino-3-(4-hydroxy-2,6-dimethyl-ph...) Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)NCCCCNC(=O)[C@H](N)Cc1c(C)cc(O)cc1C Show InChI InChI=1S/C26H38N4O4/c1-15-9-19(31)10-16(2)21(15)13-23(27)25(33)29-7-5-6-8-30-26(34)24(28)14-22-17(3)11-20(32)12-18(22)4/h9-12,23-24,31-32H,5-8,13-14,27-28H2,1-4H3,(H,29,33)(H,30,34)/t23-,24+	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	53	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Binding affinity for Opioid receptor delta 1 using [3H]-DPDPE in rat brain P2 synaptosomal preparation				J Med Chem 46: 3201-9 (2003) Article DOI: 10.1021/jm020459z BindingDB Entry DOI: 10.7270/Q28C9VMQ
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Rattus norvegicus (rat))	BDBM50130612 (2-Amino-N-[4-(2-amino-3-phenyl-propionylamino)-but...) Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)NCCCCNC(=O)[C@H](N)Cc1ccccc1 Show InChI InChI=1S/C24H34N4O3/c1-16-12-19(29)13-17(2)20(16)15-22(26)24(31)28-11-7-6-10-27-23(30)21(25)14-18-8-4-3-5-9-18/h3-5,8-9,12-13,21-22,29H,6-7,10-11,14-15,25-26H2,1-2H3,(H,27,30)(H,28,31)/t21-,22+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	62	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Binding affinity for Opioid receptor delta 1 using [3H]-DPDPE in rat brain P2 synaptosomal preparation				J Med Chem 46: 3201-9 (2003) Article DOI: 10.1021/jm020459z BindingDB Entry DOI: 10.7270/Q28C9VMQ
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Rattus norvegicus (rat))	BDBM50130614 (2-Amino-N-{2-[2-amino-3-(4-hydroxy-2,6-dimethyl-ph...) Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)NCCNC(=O)[C@H](N)Cc1c(C)cc(O)cc1C Show InChI InChI=1S/C24H34N4O4/c1-13-7-17(29)8-14(2)19(13)11-21(25)23(31)27-5-6-28-24(32)22(26)12-20-15(3)9-18(30)10-16(20)4/h7-10,21-22,29-30H,5-6,11-12,25-26H2,1-4H3,(H,27,31)(H,28,32)/t21-,22+	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	116	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Binding affinity for Opioid receptor delta 1 using [3H]-DPDPE in rat brain P2 synaptosomal preparation				J Med Chem 46: 3201-9 (2003) Article DOI: 10.1021/jm020459z BindingDB Entry DOI: 10.7270/Q28C9VMQ
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Rattus norvegicus (rat))	BDBM50130613 (2-Amino-N-{4-[2-amino-3-(4-hydroxy-phenyl)-propion...) Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)NCCCCNC(=O)[C@H](N)Cc1ccc(O)cc1 Show InChI InChI=1S/C24H34N4O4/c1-15-11-19(30)12-16(2)20(15)14-22(26)24(32)28-10-4-3-9-27-23(31)21(25)13-17-5-7-18(29)8-6-17/h5-8,11-12,21-22,29-30H,3-4,9-10,13-14,25-26H2,1-2H3,(H,27,31)(H,28,32)/t21-,22+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	133	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Binding affinity for Opioid receptor delta 1 using [3H]-DPDPE in rat brain P2 synaptosomal preparation				J Med Chem 46: 3201-9 (2003) Article DOI: 10.1021/jm020459z BindingDB Entry DOI: 10.7270/Q28C9VMQ
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50130618 (2-Amino-N-{4-[2-amino-3-(4-hydroxy-phenyl)-propion...) Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)NCCCCNC(=O)[C@H](N)Cc1ccc(O)cc1 Show InChI InChI=1S/C22H30N4O4/c23-19(13-15-3-7-17(27)8-4-15)21(29)25-11-1-2-12-26-22(30)20(24)14-16-5-9-18(28)10-6-16/h3-10,19-20,27-28H,1-2,11-14,23-24H2,(H,25,29)(H,26,30)/t19-,20+	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	309	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Binding affinity for Opioid receptor mu 1 using [3H]-DAGO in rat brain P2 synaptosomal preparation				J Med Chem 46: 3201-9 (2003) Article DOI: 10.1021/jm020459z BindingDB Entry DOI: 10.7270/Q28C9VMQ
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50130615 (2-Amino-N-{8-[2-amino-3-(4-hydroxy-phenyl)-propion...) Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)NCCCCCCCCNC(=O)[C@H](N)Cc1ccc(O)cc1 Show InChI InChI=1S/C26H38N4O4/c27-23(17-19-7-11-21(31)12-8-19)25(33)29-15-5-3-1-2-4-6-16-30-26(34)24(28)18-20-9-13-22(32)14-10-20/h7-14,23-24,31-32H,1-6,15-18,27-28H2,(H,29,33)(H,30,34)/t23-,24+	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	399	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Binding affinity for Opioid receptor mu 1 using [3H]-DAGO in rat brain P2 synaptosomal preparation				J Med Chem 46: 3201-9 (2003) Article DOI: 10.1021/jm020459z BindingDB Entry DOI: 10.7270/Q28C9VMQ
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50130621 (2-Amino-N-{6-[2-amino-3-(4-hydroxy-phenyl)-propion...) Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)NCCCCCCNC(=O)[C@H](N)Cc1ccc(O)cc1 Show InChI InChI=1S/C24H34N4O4/c25-21(15-17-5-9-19(29)10-6-17)23(31)27-13-3-1-2-4-14-28-24(32)22(26)16-18-7-11-20(30)12-8-18/h5-12,21-22,29-30H,1-4,13-16,25-26H2,(H,27,31)(H,28,32)/t21-,22+	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	410	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Binding affinity for Opioid receptor mu 1 using [3H]-DAGO in rat brain P2 synaptosomal preparation				J Med Chem 46: 3201-9 (2003) Article DOI: 10.1021/jm020459z BindingDB Entry DOI: 10.7270/Q28C9VMQ
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50130620 (2-Amino-N-{2-[2-amino-3-(4-hydroxy-phenyl)-propion...) Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)NCCNC(=O)[C@H](N)Cc1ccc(O)cc1 Show InChI InChI=1S/C20H26N4O4/c21-17(11-13-1-5-15(25)6-2-13)19(27)23-9-10-24-20(28)18(22)12-14-3-7-16(26)8-4-14/h1-8,17-18,25-26H,9-12,21-22H2,(H,23,27)(H,24,28)/t17-,18+	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	648	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Binding affinity for Opioid receptor mu 1 using [3H]-DAGO in rat brain P2 synaptosomal preparation				J Med Chem 46: 3201-9 (2003) Article DOI: 10.1021/jm020459z BindingDB Entry DOI: 10.7270/Q28C9VMQ
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50130616 (2-Amino-N-[4-(2-amino-3-phenyl-propionylamino)-but...) Show SMILES N[C@@H](Cc1ccccc1)C(=O)NCCCCNC(=O)[C@H](N)Cc1ccccc1 Show InChI InChI=1S/C22H30N4O2/c23-19(15-17-9-3-1-4-10-17)21(27)25-13-7-8-14-26-22(28)20(24)16-18-11-5-2-6-12-18/h1-6,9-12,19-20H,7-8,13-16,23-24H2,(H,25,27)(H,26,28)/t19-,20+	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.53E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Binding affinity for Opioid receptor mu 1 using [3H]-DAGO in rat brain P2 synaptosomal preparation				J Med Chem 46: 3201-9 (2003) Article DOI: 10.1021/jm020459z BindingDB Entry DOI: 10.7270/Q28C9VMQ
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Rattus norvegicus (rat))	BDBM50130615 (2-Amino-N-{8-[2-amino-3-(4-hydroxy-phenyl)-propion...) Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)NCCCCCCCCNC(=O)[C@H](N)Cc1ccc(O)cc1 Show InChI InChI=1S/C26H38N4O4/c27-23(17-19-7-11-21(31)12-8-19)25(33)29-15-5-3-1-2-4-6-16-30-26(34)24(28)18-20-9-13-22(32)14-10-20/h7-14,23-24,31-32H,1-6,15-18,27-28H2,(H,29,33)(H,30,34)/t23-,24+	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	6.15E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Binding affinity for Opioid receptor delta 1 using [3H]-DPDPE in rat brain P2 synaptosomal preparation				J Med Chem 46: 3201-9 (2003) Article DOI: 10.1021/jm020459z BindingDB Entry DOI: 10.7270/Q28C9VMQ
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Rattus norvegicus (rat))	BDBM50130618 (2-Amino-N-{4-[2-amino-3-(4-hydroxy-phenyl)-propion...) Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)NCCCCNC(=O)[C@H](N)Cc1ccc(O)cc1 Show InChI InChI=1S/C22H30N4O4/c23-19(13-15-3-7-17(27)8-4-15)21(29)25-11-1-2-12-26-22(30)20(24)14-16-5-9-18(28)10-6-16/h3-10,19-20,27-28H,1-2,11-14,23-24H2,(H,25,29)(H,26,30)/t19-,20+	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	6.50E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Binding affinity for Opioid receptor delta 1 using [3H]-DPDPE in rat brain P2 synaptosomal preparation				J Med Chem 46: 3201-9 (2003) Article DOI: 10.1021/jm020459z BindingDB Entry DOI: 10.7270/Q28C9VMQ
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Rattus norvegicus (rat))	BDBM50130620 (2-Amino-N-{2-[2-amino-3-(4-hydroxy-phenyl)-propion...) Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)NCCNC(=O)[C@H](N)Cc1ccc(O)cc1 Show InChI InChI=1S/C20H26N4O4/c21-17(11-13-1-5-15(25)6-2-13)19(27)23-9-10-24-20(28)18(22)12-14-3-7-16(26)8-4-14/h1-8,17-18,25-26H,9-12,21-22H2,(H,23,27)(H,24,28)/t17-,18+	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	8.29E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Binding affinity for Opioid receptor delta 1 using [3H]-DPDPE in rat brain P2 synaptosomal preparation				J Med Chem 46: 3201-9 (2003) Article DOI: 10.1021/jm020459z BindingDB Entry DOI: 10.7270/Q28C9VMQ
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Rattus norvegicus (rat))	BDBM50130621 (2-Amino-N-{6-[2-amino-3-(4-hydroxy-phenyl)-propion...) Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)NCCCCCCNC(=O)[C@H](N)Cc1ccc(O)cc1 Show InChI InChI=1S/C24H34N4O4/c25-21(15-17-5-9-19(29)10-6-17)23(31)27-13-3-1-2-4-14-28-24(32)22(26)16-18-7-11-20(30)12-8-18/h5-12,21-22,29-30H,1-4,13-16,25-26H2,(H,27,31)(H,28,32)/t21-,22+	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.19E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Binding affinity for Opioid receptor delta 1 using [3H]-DPDPE in rat brain P2 synaptosomal preparation				J Med Chem 46: 3201-9 (2003) Article DOI: 10.1021/jm020459z BindingDB Entry DOI: 10.7270/Q28C9VMQ
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Rattus norvegicus (rat))	BDBM50130616 (2-Amino-N-[4-(2-amino-3-phenyl-propionylamino)-but...) Show SMILES N[C@@H](Cc1ccccc1)C(=O)NCCCCNC(=O)[C@H](N)Cc1ccccc1 Show InChI InChI=1S/C22H30N4O2/c23-19(15-17-9-3-1-4-10-17)21(27)25-13-7-8-14-26-22(28)20(24)16-18-11-5-2-6-12-18/h1-6,9-12,19-20H,7-8,13-16,23-24H2,(H,25,27)(H,26,28)/t19-,20+	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.62E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Binding affinity for Opioid receptor delta 1 using [3H]-DPDPE in rat brain P2 synaptosomal preparation				J Med Chem 46: 3201-9 (2003) Article DOI: 10.1021/jm020459z BindingDB Entry DOI: 10.7270/Q28C9VMQ
					More data for this Ligand-Target Pair
Mu-type opioid receptor (GUINEA PIG)	BDBM50130617 (2-Amino-N-{6-[2-amino-3-(4-hydroxy-2,6-dimethyl-ph...) Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)NCCCCCCNC(=O)[C@H](N)Cc1c(C)cc(O)cc1C Show InChI InChI=1S/C28H42N4O4/c1-17-11-21(33)12-18(2)23(17)15-25(29)27(35)31-9-7-5-6-8-10-32-28(36)26(30)16-24-19(3)13-22(34)14-20(24)4/h11-14,25-26,33-34H,5-10,15-16,29-30H2,1-4H3,(H,31,35)(H,32,36)/t25-,26+	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.10	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Opioid receptor mu 1 agonism in guinea pig ileum				J Med Chem 46: 3201-9 (2003) Article DOI: 10.1021/jm020459z BindingDB Entry DOI: 10.7270/Q28C9VMQ
					More data for this Ligand-Target Pair
Mu-type opioid receptor (GUINEA PIG)	BDBM50130611 (2-Amino-N-{4-[2-amino-3-(4-hydroxy-2,6-dimethyl-ph...) Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)NCCCCNC(=O)[C@H](N)Cc1c(C)cc(O)cc1C Show InChI InChI=1S/C26H38N4O4/c1-15-9-19(31)10-16(2)21(15)13-23(27)25(33)29-7-5-6-8-30-26(34)24(28)14-22-17(3)11-20(32)12-18(22)4/h9-12,23-24,31-32H,5-8,13-14,27-28H2,1-4H3,(H,29,33)(H,30,34)/t23-,24+	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.30	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Opioid receptor mu 1 agonism in guinea pig ileum				J Med Chem 46: 3201-9 (2003) Article DOI: 10.1021/jm020459z BindingDB Entry DOI: 10.7270/Q28C9VMQ
					More data for this Ligand-Target Pair
Mu-type opioid receptor (GUINEA PIG)	BDBM50130619 (2-Amino-N-{8-[2-amino-3-(4-hydroxy-2,6-dimethyl-ph...) Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)NCCCCCCCCNC(=O)[C@H](N)Cc1c(C)cc(O)cc1C Show InChI InChI=1S/C30H46N4O4/c1-19-13-23(35)14-20(2)25(19)17-27(31)29(37)33-11-9-7-5-6-8-10-12-34-30(38)28(32)18-26-21(3)15-24(36)16-22(26)4/h13-16,27-28,35-36H,5-12,17-18,31-32H2,1-4H3,(H,33,37)(H,34,38)/t27-,28+	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	54	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Opioid receptor mu 1 agonism in guinea pig ileum				J Med Chem 46: 3201-9 (2003) Article DOI: 10.1021/jm020459z BindingDB Entry DOI: 10.7270/Q28C9VMQ
					More data for this Ligand-Target Pair
Mu-type opioid receptor (GUINEA PIG)	BDBM50130612 (2-Amino-N-[4-(2-amino-3-phenyl-propionylamino)-but...) Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)NCCCCNC(=O)[C@H](N)Cc1ccccc1 Show InChI InChI=1S/C24H34N4O3/c1-16-12-19(29)13-17(2)20(16)15-22(26)24(31)28-11-7-6-10-27-23(30)21(25)14-18-8-4-3-5-9-18/h3-5,8-9,12-13,21-22,29H,6-7,10-11,14-15,25-26H2,1-2H3,(H,27,30)(H,28,31)/t21-,22+/m1/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	181	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Opioid receptor mu 1 agonism in guinea pig ileum				J Med Chem 46: 3201-9 (2003) Article DOI: 10.1021/jm020459z BindingDB Entry DOI: 10.7270/Q28C9VMQ
					More data for this Ligand-Target Pair
Mu-type opioid receptor (GUINEA PIG)	BDBM50130613 (2-Amino-N-{4-[2-amino-3-(4-hydroxy-phenyl)-propion...) Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)NCCCCNC(=O)[C@H](N)Cc1ccc(O)cc1 Show InChI InChI=1S/C24H34N4O4/c1-15-11-19(30)12-16(2)20(15)14-22(26)24(32)28-10-4-3-9-27-23(31)21(25)13-17-5-7-18(29)8-6-17/h5-8,11-12,21-22,29-30H,3-4,9-10,13-14,25-26H2,1-2H3,(H,27,31)(H,28,32)/t21-,22+/m1/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	255	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Opioid receptor mu 1 agonism in guinea pig ileum				J Med Chem 46: 3201-9 (2003) Article DOI: 10.1021/jm020459z BindingDB Entry DOI: 10.7270/Q28C9VMQ
					More data for this Ligand-Target Pair
Mu-type opioid receptor (GUINEA PIG)	BDBM50130614 (2-Amino-N-{2-[2-amino-3-(4-hydroxy-2,6-dimethyl-ph...) Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)NCCNC(=O)[C@H](N)Cc1c(C)cc(O)cc1C Show InChI InChI=1S/C24H34N4O4/c1-13-7-17(29)8-14(2)19(13)11-21(25)23(31)27-5-6-28-24(32)22(26)12-20-15(3)9-18(30)10-16(20)4/h7-10,21-22,29-30H,5-6,11-12,25-26H2,1-4H3,(H,27,31)(H,28,32)/t21-,22+	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.84E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Opioid receptor mu 1 agonism in guinea pig ileum				J Med Chem 46: 3201-9 (2003) Article DOI: 10.1021/jm020459z BindingDB Entry DOI: 10.7270/Q28C9VMQ
					More data for this Ligand-Target Pair
Delta-type opioid receptor (MOUSE)	BDBM50130613 (2-Amino-N-{4-[2-amino-3-(4-hydroxy-phenyl)-propion...) Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)NCCCCNC(=O)[C@H](N)Cc1ccc(O)cc1 Show InChI InChI=1S/C24H34N4O4/c1-15-11-19(30)12-16(2)20(15)14-22(26)24(32)28-10-4-3-9-27-23(31)21(25)13-17-5-7-18(29)8-6-17/h5-8,11-12,21-22,29-30H,3-4,9-10,13-14,25-26H2,1-2H3,(H,27,31)(H,28,32)/t21-,22+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Opioid receptor delta 1 agonism in mouse vas deferens				J Med Chem 46: 3201-9 (2003) Article DOI: 10.1021/jm020459z BindingDB Entry DOI: 10.7270/Q28C9VMQ
					More data for this Ligand-Target Pair
Delta-type opioid receptor (MOUSE)	BDBM50130611 (2-Amino-N-{4-[2-amino-3-(4-hydroxy-2,6-dimethyl-ph...) Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)NCCCCNC(=O)[C@H](N)Cc1c(C)cc(O)cc1C Show InChI InChI=1S/C26H38N4O4/c1-15-9-19(31)10-16(2)21(15)13-23(27)25(33)29-7-5-6-8-30-26(34)24(28)14-22-17(3)11-20(32)12-18(22)4/h9-12,23-24,31-32H,5-8,13-14,27-28H2,1-4H3,(H,29,33)(H,30,34)/t23-,24+	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Opioid receptor delta 1 agonism in mouse vas deferens				J Med Chem 46: 3201-9 (2003) Article DOI: 10.1021/jm020459z BindingDB Entry DOI: 10.7270/Q28C9VMQ
					More data for this Ligand-Target Pair
Delta-type opioid receptor (MOUSE)	BDBM50130619 (2-Amino-N-{8-[2-amino-3-(4-hydroxy-2,6-dimethyl-ph...) Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)NCCCCCCCCNC(=O)[C@H](N)Cc1c(C)cc(O)cc1C Show InChI InChI=1S/C30H46N4O4/c1-19-13-23(35)14-20(2)25(19)17-27(31)29(37)33-11-9-7-5-6-8-10-12-34-30(38)28(32)18-26-21(3)15-24(36)16-22(26)4/h13-16,27-28,35-36H,5-12,17-18,31-32H2,1-4H3,(H,33,37)(H,34,38)/t27-,28+	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Opioid receptor delta 1 agonism in mouse vas deferens				J Med Chem 46: 3201-9 (2003) Article DOI: 10.1021/jm020459z BindingDB Entry DOI: 10.7270/Q28C9VMQ
					More data for this Ligand-Target Pair
Delta-type opioid receptor (MOUSE)	BDBM50130617 (2-Amino-N-{6-[2-amino-3-(4-hydroxy-2,6-dimethyl-ph...) Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)NCCCCCCNC(=O)[C@H](N)Cc1c(C)cc(O)cc1C Show InChI InChI=1S/C28H42N4O4/c1-17-11-21(33)12-18(2)23(17)15-25(29)27(35)31-9-7-5-6-8-10-32-28(36)26(30)16-24-19(3)13-22(34)14-20(24)4/h11-14,25-26,33-34H,5-10,15-16,29-30H2,1-4H3,(H,31,35)(H,32,36)/t25-,26+	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Opioid receptor delta 1 agonism in mouse vas deferens				J Med Chem 46: 3201-9 (2003) Article DOI: 10.1021/jm020459z BindingDB Entry DOI: 10.7270/Q28C9VMQ
					More data for this Ligand-Target Pair
Delta-type opioid receptor (MOUSE)	BDBM50130612 (2-Amino-N-[4-(2-amino-3-phenyl-propionylamino)-but...) Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)NCCCCNC(=O)[C@H](N)Cc1ccccc1 Show InChI InChI=1S/C24H34N4O3/c1-16-12-19(29)13-17(2)20(16)15-22(26)24(31)28-11-7-6-10-27-23(30)21(25)14-18-8-4-3-5-9-18/h3-5,8-9,12-13,21-22,29H,6-7,10-11,14-15,25-26H2,1-2H3,(H,27,30)(H,28,31)/t21-,22+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Opioid receptor delta 1 agonism in mouse vas deferens				J Med Chem 46: 3201-9 (2003) Article DOI: 10.1021/jm020459z BindingDB Entry DOI: 10.7270/Q28C9VMQ
					More data for this Ligand-Target Pair
Delta-type opioid receptor (MOUSE)	BDBM50130614 (2-Amino-N-{2-[2-amino-3-(4-hydroxy-2,6-dimethyl-ph...) Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)NCCNC(=O)[C@H](N)Cc1c(C)cc(O)cc1C Show InChI InChI=1S/C24H34N4O4/c1-13-7-17(29)8-14(2)19(13)11-21(25)23(31)27-5-6-28-24(32)22(26)12-20-15(3)9-18(30)10-16(20)4/h7-10,21-22,29-30H,5-6,11-12,25-26H2,1-4H3,(H,27,31)(H,28,32)/t21-,22+	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Kobe Gakuin University Curated by ChEMBL					Assay Description Opioid receptor delta 1 agonism in mouse vas deferens				J Med Chem 46: 3201-9 (2003) Article DOI: 10.1021/jm020459z BindingDB Entry DOI: 10.7270/Q28C9VMQ
					More data for this Ligand-Target Pair