Compile Data Set for Download or QSAR

Found 54 hits Enz. Inhib. hit(s) with all data for assayid = 1 entry = 7646   

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 (Homo sapiens (Human))	BDBM208981 ((4R,4aR,7S,7aR,12bS)-3-methyl-2,3,4,4a,7,7a-hexahy...) Show SMILES CO[C@H]1C=CC2C3Cc4ccc(O)c5OC1[C@]2(CCN3C)c45 |r,c:3,TLB:13:21:5:19.17.18,9:8:5:19.17.18| Show InChI InChI=1S/C18H21NO3/c1-19-8-7-18-11-4-6-14(21-2)17(18)22-16-13(20)5-3-10(15(16)18)9-12(11)19/h3-6,11-12,14,17,20H,7-9H2,1-2H3/t11?,12?,14-,17?,18-/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	8.44	-46.1	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM208982 (US9233167, a-6-mPEG1-O-Morphine) Show SMILES COCCO[C@H]1CC[C@@]2(O)C3Cc4ccc(O)c5O[C@@H]1[C@]2(CCN3C)c45 |r,TLB:17:25:8:23.21.22,13:12:8:23.21.22| Show InChI InChI=1S/C20H27NO5/c1-21-8-7-19-16-12-3-4-13(22)17(16)26-18(19)14(25-10-9-24-2)5-6-20(19,23)15(21)11-12/h3-4,14-15,18,22-23H,5-11H2,1-2H3/t14-,15?,18-,19-,20+/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	15.7	-44.5	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM208983 (US9233167, a-6-mPEG2-O-Morphine) Show SMILES COCCOCCO[C@H]1CC[C@@]2(O)C3Cc4ccc(O)c5O[C@@H]1[C@]2(CCN3C)c45 |r,TLB:20:28:11:26.24.25,16:15:11:26.24.25| Show InChI InChI=1S/C22H31NO6/c1-23-8-7-21-18-14-3-4-15(24)19(18)29-20(21)16(28-12-11-27-10-9-26-2)5-6-22(21,25)17(23)13-14/h3-4,16-17,20,24-25H,5-13H2,1-2H3/t16-,17?,20-,21-,22+/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	22.0	-43.7	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM208985 (US9233167, a-6-mPEG4-O-Morphine) Show SMILES COCCOCCOCCOCCO[C@H]1CC[C@@]2(O)C3Cc4ccc(O)c5O[C@@H]1[C@]2(CCN3C)c45 |r,TLB:26:34:17:32.30.31,22:21:17:32.30.31| Show InChI InChI=1S/C26H39NO8/c1-27-8-7-25-22-18-3-4-19(28)23(22)35-24(25)20(5-6-26(25,29)21(27)17-18)34-16-15-33-14-13-32-12-11-31-10-9-30-2/h3-4,20-21,24,28-29H,5-17H2,1-2H3/t20-,21?,24-,25-,26+/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	23.1	-43.6	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM208986 (US9233167, a-6-mPEG5-O-Morphine) Show SMILES COCCOCCOCCOCCOCCO[C@H]1CC[C@@]2(O)C3Cc4ccc(O)c5O[C@@H]1[C@]2(CCN3C)c45 |r,TLB:29:37:20:35.33.34,25:24:20:35.33.34| Show InChI InChI=1S/C28H43NO9/c1-29-8-7-27-24-20-3-4-21(30)25(24)38-26(27)22(5-6-28(27,31)23(29)19-20)37-18-17-36-16-15-35-14-13-34-12-11-33-10-9-32-2/h3-4,22-23,26,30-31H,5-19H2,1-2H3/t22-,23?,26-,27-,28+/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	39.4	-42.3	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM208984 (US9233167, a-6-mPEG3-O-Morphine) Show SMILES COCCOCCOCCO[C@H]1CC[C@@]2(O)C3Cc4ccc(O)c5O[C@@H]1[C@]2(CCN3C)c45 |r,TLB:23:31:14:29.27.28,19:18:14:29.27.28| Show InChI InChI=1S/C24H35NO7/c1-25-8-7-23-20-16-3-4-17(26)21(20)32-22(23)18(5-6-24(23,27)19(25)15-16)31-14-13-30-12-11-29-10-9-28-2/h3-4,18-19,22,26-27H,5-15H2,1-2H3/t18-,19?,22-,23-,24+/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	50.7	-41.6	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM208988 (US9233167, a-6-mPEG7-O-Morphine) Show SMILES COCCOCCOCCOCCOCCOCCOCCO[C@H]1CC[C@@]2(O)C3Cc4ccc(O)c5O[C@@H]1[C@]2(CCN3C)c45 |r,TLB:35:43:26:41.39.40,31:30:26:41.39.40| Show InChI InChI=1S/C32H51NO11/c1-33-8-7-31-28-24-3-4-25(34)29(28)44-30(31)26(5-6-32(31,35)27(33)23-24)43-22-21-42-20-19-41-18-17-40-16-15-39-14-13-38-12-11-37-10-9-36-2/h3-4,26-27,30,34-35H,5-23H2,1-2H3/t26-,27?,30-,31-,32+/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	56.9	-41.4	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM208987 (US9233167, a-6-mPEG6-O-Morphine) Show SMILES COCCOCCOCCOCCOCCOCCO[C@H]1CC[C@@]2(O)C3Cc4ccc(O)c5O[C@@H]1[C@]2(CCN3C)c45 |r,TLB:32:40:23:38.36.37,28:27:23:38.36.37| Show InChI InChI=1S/C30H47NO10/c1-31-8-7-29-26-22-3-4-23(32)27(26)41-28(29)24(5-6-30(29,33)25(31)21-22)40-20-19-39-18-17-38-16-15-37-14-13-36-12-11-35-10-9-34-2/h3-4,24-25,28,32-33H,5-21H2,1-2H3/t24-,25?,28-,29-,30+/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	73.0	-40.7	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM208989 (US9233167, a-6-mPEG9-O-Morphine) Show SMILES COCCOCCOCCOCCOCCOCCOCCOCCOCCO[C@H]1CC[C@@]2(O)C3Cc4ccc(O)c5O[C@@H]1[C@]2(CCN3C)c45 |r,TLB:41:49:32:47.45.46,37:36:32:47.45.46| Show InChI InChI=1S/C36H59NO13/c1-37-8-7-35-32-28-3-4-29(38)33(32)50-34(35)30(5-6-36(35,39)31(37)27-28)49-26-25-48-24-23-47-22-21-46-20-19-45-18-17-44-16-15-43-14-13-42-12-11-41-10-9-40-2/h3-4,30-31,34,38-39H,5-27H2,1-2H3/t30-,31?,34-,35-,36+/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	111	-39.7	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM208981 ((4R,4aR,7S,7aR,12bS)-3-methyl-2,3,4,4a,7,7a-hexahy...) Show SMILES CO[C@H]1C=CC2C3Cc4ccc(O)c5OC1[C@]2(CCN3C)c45 |r,c:3,TLB:13:21:5:19.17.18,9:8:5:19.17.18| Show InChI InChI=1S/C18H21NO3/c1-19-8-7-18-11-4-6-14(21-2)17(18)22-16-13(20)5-3-10(15(16)18)9-12(11)19/h3-6,11-12,14,17,20H,7-9H2,1-2H3/t11?,12?,14-,17?,18-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	118	-39.5	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM50370595 (OXYCODONE | Oxycontin | US1184575, oxycodone | US9...) Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)C(=O)CC[C@@]35O |TLB:20:21:16.5.6:8.11.10,THB:22:21:16.5.6:8.11.10| Show InChI InChI=1S/C18H21NO4/c1-19-8-7-17-14-10-3-4-12(22-2)15(14)23-16(17)11(20)5-6-18(17,21)13(19)9-10/h3-4,13,16,21H,5-9H2,1-2H3/t13-,16+,17+,18-/m1/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase DrugBank KEGG PC cid PC sid PDB UniChem Similars	DrugBank US Patent	133	-39.2	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM208983 (US9233167, a-6-mPEG2-O-Morphine) Show SMILES COCCOCCO[C@H]1CC[C@@]2(O)C3Cc4ccc(O)c5O[C@@H]1[C@]2(CCN3C)c45 |r,TLB:20:28:11:26.24.25,16:15:11:26.24.25| Show InChI InChI=1S/C22H31NO6/c1-23-8-7-21-18-14-3-4-15(24)19(18)29-20(21)16(28-12-11-27-10-9-26-2)5-6-22(21,25)17(23)13-14/h3-4,16-17,20,24-25H,5-13H2,1-2H3/t16-,17?,20-,21-,22+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	404	-36.5	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM208985 (US9233167, a-6-mPEG4-O-Morphine) Show SMILES COCCOCCOCCOCCO[C@H]1CC[C@@]2(O)C3Cc4ccc(O)c5O[C@@H]1[C@]2(CCN3C)c45 |r,TLB:26:34:17:32.30.31,22:21:17:32.30.31| Show InChI InChI=1S/C26H39NO8/c1-27-8-7-25-22-18-3-4-19(28)23(22)35-24(25)20(5-6-26(25,29)21(27)17-18)34-16-15-33-14-13-32-12-11-31-10-9-30-2/h3-4,20-21,24,28-29H,5-17H2,1-2H3/t20-,21?,24-,25-,26+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	439	-36.3	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM208982 (US9233167, a-6-mPEG1-O-Morphine) Show SMILES COCCO[C@H]1CC[C@@]2(O)C3Cc4ccc(O)c5O[C@@H]1[C@]2(CCN3C)c45 |r,TLB:17:25:8:23.21.22,13:12:8:23.21.22| Show InChI InChI=1S/C20H27NO5/c1-21-8-7-19-16-12-3-4-13(22)17(16)26-18(19)14(25-10-9-24-2)5-6-20(19,23)15(21)11-12/h3-4,14-15,18,22-23H,5-11H2,1-2H3/t14-,15?,18-,19-,20+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	445	-36.3	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM208986 (US9233167, a-6-mPEG5-O-Morphine) Show SMILES COCCOCCOCCOCCOCCO[C@H]1CC[C@@]2(O)C3Cc4ccc(O)c5O[C@@H]1[C@]2(CCN3C)c45 |r,TLB:29:37:20:35.33.34,25:24:20:35.33.34| Show InChI InChI=1S/C28H43NO9/c1-29-8-7-27-24-20-3-4-21(30)25(24)38-26(27)22(5-6-28(27,31)23(29)19-20)37-18-17-36-16-15-35-14-13-34-12-11-33-10-9-32-2/h3-4,22-23,26,30-31H,5-19H2,1-2H3/t22-,23?,26-,27-,28+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	558	-35.7	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM208984 (US9233167, a-6-mPEG3-O-Morphine) Show SMILES COCCOCCOCCO[C@H]1CC[C@@]2(O)C3Cc4ccc(O)c5O[C@@H]1[C@]2(CCN3C)c45 |r,TLB:23:31:14:29.27.28,19:18:14:29.27.28| Show InChI InChI=1S/C24H35NO7/c1-25-8-7-23-20-16-3-4-17(26)21(20)32-22(23)18(5-6-24(23,27)19(25)15-16)31-14-13-30-12-11-29-10-9-28-2/h3-4,18-19,22,26-27H,5-15H2,1-2H3/t18-,19?,22-,23-,24+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	576	-35.6	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM208991 (US9233167, a-6-mPEG2-O-Hydroxycodone) Show SMILES COCCOCCO[C@H]1CC[C@@]2(O)C3Cc4ccc(OC)c5O[C@@H]1[C@]2(CCN3C)c45 |r,TLB:21:29:11:27.25.26,16:15:11:27.25.26| Show InChI InChI=1S/C23H33NO6/c1-24-9-8-22-19-15-4-5-16(27-3)20(19)30-21(22)17(29-13-12-28-11-10-26-2)6-7-23(22,25)18(24)14-15/h4-5,17-18,21,25H,6-14H2,1-3H3/t17-,18?,21-,22-,23+/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	632	-35.4	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM208990 (US9233167, a-6-mPEG1-O-Hydroxycodone) Show SMILES COCCO[C@H]1CC[C@@]2(O)C3Cc4ccc(OC)c5O[C@@H]1[C@]2(CCN3C)c45 |r,TLB:18:26:8:24.22.23,13:12:8:24.22.23| Show InChI InChI=1S/C21H29NO5/c1-22-9-8-20-17-13-4-5-14(25-3)18(17)27-19(20)15(26-11-10-24-2)6-7-21(20,23)16(22)12-13/h4-5,15-16,19,23H,6-12H2,1-3H3/t15-,16?,19-,20-,21+/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	654	-35.3	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM208988 (US9233167, a-6-mPEG7-O-Morphine) Show SMILES COCCOCCOCCOCCOCCOCCOCCO[C@H]1CC[C@@]2(O)C3Cc4ccc(O)c5O[C@@H]1[C@]2(CCN3C)c45 |r,TLB:35:43:26:41.39.40,31:30:26:41.39.40| Show InChI InChI=1S/C32H51NO11/c1-33-8-7-31-28-24-3-4-25(34)29(28)44-30(31)26(5-6-32(31,35)27(33)23-24)43-22-21-42-20-19-41-18-17-40-16-15-39-14-13-38-12-11-37-10-9-36-2/h3-4,26-27,30,34-35H,5-23H2,1-2H3/t26-,27?,30-,31-,32+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	670	-35.2	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM208987 (US9233167, a-6-mPEG6-O-Morphine) Show SMILES COCCOCCOCCOCCOCCOCCO[C@H]1CC[C@@]2(O)C3Cc4ccc(O)c5O[C@@H]1[C@]2(CCN3C)c45 |r,TLB:32:40:23:38.36.37,28:27:23:38.36.37| Show InChI InChI=1S/C30H47NO10/c1-31-8-7-29-26-22-3-4-23(32)27(26)41-28(29)24(5-6-30(29,33)25(31)21-22)40-20-19-39-18-17-38-16-15-37-14-13-36-12-11-35-10-9-34-2/h3-4,24-25,28,32-33H,5-21H2,1-2H3/t24-,25?,28-,29-,30+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	774	-34.9	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM208992 (US9233167, a-6-mPEG3-O-Hydroxycodone) Show SMILES COCCOCCOCCO[C@H]1CC[C@@]2(O)C3Cc4ccc(OC)c5O[C@@H]1[C@]2(CCN3C)c45 |r,TLB:24:32:14:30.28.29,19:18:14:30.28.29| Show InChI InChI=1S/C25H37NO7/c1-26-9-8-24-21-17-4-5-18(29-3)22(21)33-23(24)19(6-7-25(24,27)20(26)16-17)32-15-14-31-13-12-30-11-10-28-2/h4-5,19-20,23,27H,6-16H2,1-3H3/t19-,20?,23-,24-,25+/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	775	-34.9	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM208993 (US9233167, a-6-mPEG4-O-Hydroxycodone) Show SMILES COCCOCCOCCOCCO[C@H]1CC[C@@]2(O)C3Cc4ccc(OC)c5O[C@@H]1[C@]2(CCN3C)c45 |r,TLB:27:35:17:33.31.32,22:21:17:33.31.32| Show InChI InChI=1S/C27H41NO8/c1-28-9-8-26-23-19-4-5-20(31-3)24(23)36-25(26)21(6-7-27(26,29)22(28)18-19)35-17-16-34-15-14-33-13-12-32-11-10-30-2/h4-5,21-22,25,29H,6-18H2,1-3H3/t21-,22?,25-,26-,27+/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	893	-34.5	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM208989 (US9233167, a-6-mPEG9-O-Morphine) Show SMILES COCCOCCOCCOCCOCCOCCOCCOCCOCCO[C@H]1CC[C@@]2(O)C3Cc4ccc(O)c5O[C@@H]1[C@]2(CCN3C)c45 |r,TLB:41:49:32:47.45.46,37:36:32:47.45.46| Show InChI InChI=1S/C36H59NO13/c1-37-8-7-35-32-28-3-4-29(38)33(32)50-34(35)30(5-6-36(35,39)31(37)27-28)49-26-25-48-24-23-47-22-21-46-20-19-45-18-17-44-16-15-43-14-13-42-12-11-41-10-9-40-2/h3-4,30-31,34,38-39H,5-27H2,1-2H3/t30-,31?,34-,35-,36+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.25E+3	-33.7	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM208999 (US9233167, a-6-mPEG2-O-Codeine) Show SMILES COCCOCCO[C@H]1C=CC2C3Cc4ccc(OC)c5OC1[C@]2(CCN3C)c45 |r,c:9,TLB:20:28:11:26.24.25,15:14:11:26.24.25| Show InChI InChI=1S/C23H31NO5/c1-24-9-8-23-16-5-7-19(28-13-12-27-11-10-25-2)22(23)29-21-18(26-3)6-4-15(20(21)23)14-17(16)24/h4-7,16-17,19,22H,8-14H2,1-3H3/t16?,17?,19-,22?,23-/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.38E+3	-33.4	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM208996 (US9233167, a-6-mPEG5-O-Hydroxycodone) Show SMILES COCCOCCOCCOCCOCCOCCOCCO[C@H]1CC[C@@]2(O)C3Cc4ccc(OC)c5O[C@@H]1[C@]2(CCN3C)c45 |r,TLB:36:44:26:42.40.41,31:30:26:42.40.41| Show InChI InChI=1S/C33H53NO11/c1-34-9-8-32-29-25-4-5-26(37-3)30(29)45-31(32)27(6-7-33(32,35)28(34)24-25)44-23-22-43-21-20-42-19-18-41-17-16-40-15-14-39-13-12-38-11-10-36-2/h4-5,27-28,31,35H,6-24H2,1-3H3/t27-,28?,31-,32-,33+/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.61E+3	-33.1	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM208980 (US9233167, a-6-mPEG1-O-Codeine) Show SMILES COCCO[C@H]1C=CC2C3Cc4ccc(OC)c5OC1[C@]2(CCN3C)c45 |r,c:6,TLB:17:25:8:23.21.22,12:11:8:23.21.22| Show InChI InChI=1S/C21H27NO4/c1-22-9-8-21-14-5-7-17(25-11-10-23-2)20(21)26-19-16(24-3)6-4-13(18(19)21)12-15(14)22/h4-7,14-15,17,20H,8-12H2,1-3H3/t14?,15?,17-,20?,21-/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.82E+3	-32.8	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM208994 (US9233167, a-6-mPEG5-O-Hydroxycodone) Show SMILES COCCOCCOCCOCCOCCO[C@H]1CC[C@@]2(O)C3Cc4ccc(OC)c5O[C@@H]1[C@]2(CCN3C)c45 |r,TLB:30:38:20:36.34.35,25:24:20:36.34.35| Show InChI InChI=1S/C29H45NO9/c1-30-9-8-28-25-21-4-5-22(33-3)26(25)39-27(28)23(6-7-29(28,31)24(30)20-21)38-19-18-37-17-16-36-15-14-35-13-12-34-11-10-32-2/h4-5,23-24,27,31H,6-20H2,1-3H3/t23-,24?,27-,28-,29+/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.86E+3	-32.7	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM208995 (US9233167, a-6-mPEG5-O-Hydroxycodone) Show SMILES COCCOCCOCCOCCOCCOCCO[C@H]1CC[C@@]2(O)C3Cc4ccc(OC)c5O[C@@H]1[C@]2(CCN3C)c45 |r,TLB:33:41:23:39.37.38,28:27:23:39.37.38| Show InChI InChI=1S/C31H49NO10/c1-32-9-8-30-27-23-4-5-24(35-3)28(27)42-29(30)25(6-7-31(30,33)26(32)22-23)41-21-20-40-19-18-39-17-16-38-15-14-37-13-12-36-11-10-34-2/h4-5,25-26,29,33H,6-22H2,1-3H3/t25-,26?,29-,30-,31+/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.90E+3	-32.7	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM208998 ((4R,4aR,7S,7aR,12bS)-9-methoxy-3-methyl-2,4,4a,7,7...) Show SMILES COc1ccc2C[C@@H]3C4C=C[C@H](O)[C@@H]5Oc1c2[C@]45CCN3C |r,c:9,THB:9:8:16.5.6:18.20.19| Show InChI InChI=1S/C18H21NO3/c1-19-8-7-18-11-4-5-13(20)17(18)22-16-14(21-2)6-3-10(15(16)18)9-12(11)19/h3-6,11-13,17,20H,7-9H2,1-2H3/t11?,12-,13+,17+,18+/m1/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	US Patent	1.95E+3	-32.6	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM209002 (US9233167, a-6-mPEG3-O-Codeine) Show SMILES COCCOCCOCCOCCOCCO[C@H]1C=CC2C3Cc4ccc(OC)c5OC1[C@]2(CCN3C)c45 |r,c:18,TLB:29:37:20:35.33.34,24:23:20:35.33.34| Show InChI InChI=1S/C29H43NO8/c1-30-9-8-29-22-5-7-25(28(29)38-27-24(32-3)6-4-21(26(27)29)20-23(22)30)37-19-18-36-17-16-35-15-14-34-13-12-33-11-10-31-2/h4-7,22-23,25,28H,8-20H2,1-3H3/t22?,23?,25-,28?,29-/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	2.43E+3	-32.0	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM208988 (US9233167, a-6-mPEG7-O-Morphine) Show SMILES COCCOCCOCCOCCOCCOCCOCCO[C@H]1CC[C@@]2(O)C3Cc4ccc(O)c5O[C@@H]1[C@]2(CCN3C)c45 |r,TLB:35:43:26:41.39.40,31:30:26:41.39.40| Show InChI InChI=1S/C32H51NO11/c1-33-8-7-31-28-24-3-4-25(34)29(28)44-30(31)26(5-6-32(31,35)27(33)23-24)43-22-21-42-20-19-41-18-17-40-16-15-39-14-13-38-12-11-37-10-9-36-2/h3-4,26-27,30,34-35H,5-23H2,1-2H3/t26-,27?,30-,31-,32+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	2.59E+3	-31.9	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM208987 (US9233167, a-6-mPEG6-O-Morphine) Show SMILES COCCOCCOCCOCCOCCOCCO[C@H]1CC[C@@]2(O)C3Cc4ccc(O)c5O[C@@H]1[C@]2(CCN3C)c45 |r,TLB:32:40:23:38.36.37,28:27:23:38.36.37| Show InChI InChI=1S/C30H47NO10/c1-31-8-7-29-26-22-3-4-23(32)27(26)41-28(29)24(5-6-30(29,33)25(31)21-22)40-20-19-39-18-17-38-16-15-37-14-13-36-12-11-35-10-9-34-2/h3-4,24-25,28,32-33H,5-21H2,1-2H3/t24-,25?,28-,29-,30+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	2.60E+3	-31.9	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM208983 (US9233167, a-6-mPEG2-O-Morphine) Show SMILES COCCOCCO[C@H]1CC[C@@]2(O)C3Cc4ccc(O)c5O[C@@H]1[C@]2(CCN3C)c45 |r,TLB:20:28:11:26.24.25,16:15:11:26.24.25| Show InChI InChI=1S/C22H31NO6/c1-23-8-7-21-18-14-3-4-15(24)19(18)29-20(21)16(28-12-11-27-10-9-26-2)5-6-22(21,25)17(23)13-14/h3-4,16-17,20,24-25H,5-13H2,1-2H3/t16-,17?,20-,21-,22+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	2.60E+3	-31.9	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM208982 (US9233167, a-6-mPEG1-O-Morphine) Show SMILES COCCO[C@H]1CC[C@@]2(O)C3Cc4ccc(O)c5O[C@@H]1[C@]2(CCN3C)c45 |r,TLB:17:25:8:23.21.22,13:12:8:23.21.22| Show InChI InChI=1S/C20H27NO5/c1-21-8-7-19-16-12-3-4-13(22)17(16)26-18(19)14(25-10-9-24-2)5-6-20(19,23)15(21)11-12/h3-4,14-15,18,22-23H,5-11H2,1-2H3/t14-,15?,18-,19-,20+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	2.72E+3	-31.8	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM208986 (US9233167, a-6-mPEG5-O-Morphine) Show SMILES COCCOCCOCCOCCOCCO[C@H]1CC[C@@]2(O)C3Cc4ccc(O)c5O[C@@H]1[C@]2(CCN3C)c45 |r,TLB:29:37:20:35.33.34,25:24:20:35.33.34| Show InChI InChI=1S/C28H43NO9/c1-29-8-7-27-24-20-3-4-21(30)25(24)38-26(27)22(5-6-28(27,31)23(29)19-20)37-18-17-36-16-15-35-14-13-34-12-11-33-10-9-32-2/h3-4,22-23,26,30-31H,5-19H2,1-2H3/t22-,23?,26-,27-,28+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	2.76E+3	-31.7	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM209001 (US9233167, a-6-mPEG3-O-Codeine) Show SMILES COCCOCCOCCOCCO[C@H]1C=CC2C3Cc4ccc(OC)c5OC1[C@]2(CCN3C)c45 |r,c:15,TLB:26:34:17:32.30.31,21:20:17:32.30.31| Show InChI InChI=1S/C27H39NO7/c1-28-9-8-27-20-5-7-23(34-17-16-33-15-14-32-13-12-31-11-10-29-2)26(27)35-25-22(30-3)6-4-19(24(25)27)18-21(20)28/h4-7,20-21,23,26H,8-18H2,1-3H3/t20?,21?,23-,26?,27-/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	2.89E+3	-31.6	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM208985 (US9233167, a-6-mPEG4-O-Morphine) Show SMILES COCCOCCOCCOCCO[C@H]1CC[C@@]2(O)C3Cc4ccc(O)c5O[C@@H]1[C@]2(CCN3C)c45 |r,TLB:26:34:17:32.30.31,22:21:17:32.30.31| Show InChI InChI=1S/C26H39NO8/c1-27-8-7-25-22-18-3-4-19(28)23(22)35-24(25)20(5-6-26(25,29)21(27)17-18)34-16-15-33-14-13-32-12-11-31-10-9-30-2/h3-4,20-21,24,28-29H,5-17H2,1-2H3/t20-,21?,24-,25-,26+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	3.36E+3	-31.2	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM208997 (US9233167, a-6-mPEG5-O-Hydroxycodone) Show SMILES COCCOCCOCCOCCOCCOCCOCCOCCOCCO[C@H]1CC[C@@]2(O)C3Cc4ccc(OC)c5O[C@@H]1[C@]2(CCN3C)c45 |r,TLB:42:50:32:48.46.47,37:36:32:48.46.47| Show InChI InChI=1S/C37H61NO13/c1-38-9-8-36-33-29-4-5-30(41-3)34(33)51-35(36)31(6-7-37(36,39)32(38)28-29)50-27-26-49-25-24-48-23-22-47-21-20-46-19-18-45-17-16-44-15-14-43-13-12-42-11-10-40-2/h4-5,31-32,35,39H,6-28H2,1-3H3/t31-,32?,35-,36-,37+/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	3.62E+3	-31.1	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM209000 (US9233167, a-6-mPEG3-O-Codeine) Show SMILES COCCOCCOCCO[C@H]1C=CC2C3Cc4ccc(OC)c5OC1[C@]2(CCN3C)c45 |r,c:12,TLB:23:31:14:29.27.28,18:17:14:29.27.28| Show InChI InChI=1S/C25H35NO6/c1-26-9-8-25-18-5-7-21(31-15-14-30-13-12-29-11-10-27-2)24(25)32-23-20(28-3)6-4-17(22(23)25)16-19(18)26/h4-7,18-19,21,24H,8-16H2,1-3H3/t18?,19?,21-,24?,25-/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	4.26E+3	-30.7	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM208981 ((4R,4aR,7S,7aR,12bS)-3-methyl-2,3,4,4a,7,7a-hexahy...) Show SMILES CO[C@H]1C=CC2C3Cc4ccc(O)c5OC1[C@]2(CCN3C)c45 |r,c:3,TLB:13:21:5:19.17.18,9:8:5:19.17.18| Show InChI InChI=1S/C18H21NO3/c1-19-8-7-18-11-4-6-14(21-2)17(18)22-16-13(20)5-3-10(15(16)18)9-12(11)19/h3-6,11-12,14,17,20H,7-9H2,1-2H3/t11?,12?,14-,17?,18-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	4.30E+3	-30.6	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM208989 (US9233167, a-6-mPEG9-O-Morphine) Show SMILES COCCOCCOCCOCCOCCOCCOCCOCCOCCO[C@H]1CC[C@@]2(O)C3Cc4ccc(O)c5O[C@@H]1[C@]2(CCN3C)c45 |r,TLB:41:49:32:47.45.46,37:36:32:47.45.46| Show InChI InChI=1S/C36H59NO13/c1-37-8-7-35-32-28-3-4-29(38)33(32)50-34(35)30(5-6-36(35,39)31(37)27-28)49-26-25-48-24-23-47-22-21-46-20-19-45-18-17-44-16-15-43-14-13-42-12-11-41-10-9-40-2/h3-4,30-31,34,38-39H,5-27H2,1-2H3/t30-,31?,34-,35-,36+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	5.78E+3	-29.9	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM208984 (US9233167, a-6-mPEG3-O-Morphine) Show SMILES COCCOCCOCCO[C@H]1CC[C@@]2(O)C3Cc4ccc(O)c5O[C@@H]1[C@]2(CCN3C)c45 |r,TLB:23:31:14:29.27.28,19:18:14:29.27.28| Show InChI InChI=1S/C24H35NO7/c1-25-8-7-23-20-16-3-4-17(26)21(20)32-22(23)18(5-6-24(23,27)19(25)15-16)31-14-13-30-12-11-29-10-9-28-2/h3-4,18-19,22,26-27H,5-15H2,1-2H3/t18-,19?,22-,23-,24+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	6.18E+3	-29.7	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM209004 (US9233167, a-6-mPEG3-O-Codeine) Show SMILES COCCOCCOCCOCCOCCOCCOCCO[C@H]1C=CC2C3Cc4ccc(OC)c5OC1[C@]2(CCN3C)c45 |r,c:24,TLB:35:43:26:41.39.40,30:29:26:41.39.40| Show InChI InChI=1S/C33H51NO10/c1-34-9-8-33-26-5-7-29(32(33)44-31-28(36-3)6-4-25(30(31)33)24-27(26)34)43-23-22-42-21-20-41-19-18-40-17-16-39-15-14-38-13-12-37-11-10-35-2/h4-7,26-27,29,32H,8-24H2,1-3H3/t26?,27?,29-,32?,33-/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	9.96E+3	-28.5	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM209005 (US9233167, a-6-mPEG3-O-Codeine) Show SMILES COCCOCCOCCOCCOCCOCCOCCOCCOCCO[C@H]1C=CC2C3Cc4ccc(OC)c5OC1[C@]2(CCN3C)c45 |r,c:30,TLB:41:49:32:47.45.46,36:35:32:47.45.46| Show InChI InChI=1S/C37H59NO12/c1-38-9-8-37-30-5-7-33(36(37)50-35-32(40-3)6-4-29(34(35)37)28-31(30)38)49-27-26-48-25-24-47-23-22-46-21-20-45-19-18-44-17-16-43-15-14-42-13-12-41-11-10-39-2/h4-7,30-31,33,36H,8-28H2,1-3H3/t30?,31?,33-,36?,37-/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	9.98E+3	-28.5	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM209003 (US9233167, a-6-mPEG3-O-Codeine) Show SMILES COCCOCCOCCOCCOCCOCCO[C@H]1C=CC2C3Cc4ccc(OC)c5OC1[C@]2(CCN3C)c45 |r,c:21,TLB:32:40:23:38.36.37,27:26:23:38.36.37| Show InChI InChI=1S/C31H47NO9/c1-32-9-8-31-24-5-7-27(30(31)41-29-26(34-3)6-4-23(28(29)31)22-25(24)32)40-21-20-39-19-18-38-17-16-37-15-14-36-13-12-35-11-10-33-2/h4-7,24-25,27,30H,8-22H2,1-3H3/t24?,25?,27-,30?,31-/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.42E+4	-27.7	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM208999 (US9233167, a-6-mPEG2-O-Codeine) Show SMILES COCCOCCO[C@H]1C=CC2C3Cc4ccc(OC)c5OC1[C@]2(CCN3C)c45 |r,c:9,TLB:20:28:11:26.24.25,15:14:11:26.24.25| Show InChI InChI=1S/C23H31NO5/c1-24-9-8-23-16-5-7-19(28-13-12-27-11-10-25-2)22(23)29-21-18(26-3)6-4-15(20(21)23)14-17(16)24/h4-7,16-17,19,22H,8-14H2,1-3H3/t16?,17?,19-,22?,23-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	2.26E+4	-26.5	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM208998 ((4R,4aR,7S,7aR,12bS)-9-methoxy-3-methyl-2,4,4a,7,7...) Show SMILES COc1ccc2C[C@@H]3C4C=C[C@H](O)[C@@H]5Oc1c2[C@]45CCN3C |r,c:9,THB:9:8:16.5.6:18.20.19| Show InChI InChI=1S/C18H21NO3/c1-19-8-7-18-11-4-5-13(20)17(18)22-16-14(21-2)6-3-10(15(16)18)9-12(11)19/h3-6,11-13,17,20H,7-9H2,1-2H3/t11?,12-,13+,17+,18+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	US Patent	2.81E+4	-26.0	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM209000 (US9233167, a-6-mPEG3-O-Codeine) Show SMILES COCCOCCOCCO[C@H]1C=CC2C3Cc4ccc(OC)c5OC1[C@]2(CCN3C)c45 |r,c:12,TLB:23:31:14:29.27.28,18:17:14:29.27.28| Show InChI InChI=1S/C25H35NO6/c1-26-9-8-25-18-5-7-21(31-15-14-30-13-12-29-11-10-27-2)24(25)32-23-20(28-3)6-4-17(22(23)25)16-19(18)26/h4-7,18-19,21,24H,8-16H2,1-3H3/t18?,19?,21-,24?,25-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	3.65E+4	-25.3	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM208980 (US9233167, a-6-mPEG1-O-Codeine) Show SMILES COCCO[C@H]1C=CC2C3Cc4ccc(OC)c5OC1[C@]2(CCN3C)c45 |r,c:6,TLB:17:25:8:23.21.22,12:11:8:23.21.22| Show InChI InChI=1S/C21H27NO4/c1-22-9-8-21-14-5-7-17(25-11-10-23-2)20(21)26-19-16(24-3)6-4-13(18(19)21)12-15(14)22/h4-7,14-15,17,20H,8-12H2,1-3H3/t14?,15?,17-,20?,21-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	5.47E+4	-24.3	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM209002 (US9233167, a-6-mPEG3-O-Codeine) Show SMILES COCCOCCOCCOCCOCCO[C@H]1C=CC2C3Cc4ccc(OC)c5OC1[C@]2(CCN3C)c45 |r,c:18,TLB:29:37:20:35.33.34,24:23:20:35.33.34| Show InChI InChI=1S/C29H43NO8/c1-30-9-8-29-22-5-7-25(28(29)38-27-24(32-3)6-4-21(26(27)29)20-23(22)30)37-19-18-36-17-16-35-15-14-34-13-12-33-11-10-31-2/h4-7,22-23,25,28H,8-20H2,1-3H3/t22?,23?,25-,28?,29-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	5.91E+4	-24.1	n/a	n/a	n/a	n/a	n/a	n/a	25
Nektar Therapeutics US Patent					Assay Description Briefly, serial dilutions of the test compounds were placed in a 96-well plate to which were added SPA beads, membrane and radioligand. The assay con...				US Patent US9233167 (2016) BindingDB Entry DOI: 10.7270/Q25T3J97
					More data for this Ligand-Target Pair

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