Compile Data Set for Download or QSAR

Found 396 hits with Last Name = 'moure' and Initial = 'a'   

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))	BDBM432134 (N-(1-Benzylpiperidin-4-yl)-N-[1-(4-fluorophenyl)-1...) Show SMILES Fc1ccc(cc1)-n1ccc(n1)N(C1CCN(Cc2ccccc2)CC1)C(=O)c1cccs1 Show InChI InChI=1S/C26H25FN4OS/c27-21-8-10-22(11-9-21)30-17-14-25(28-30)31(26(32)24-7-4-18-33-24)23-12-15-29(16-13-23)19-20-5-2-1-3-6-20/h1-11,14,17-18,23H,12-13,15-16,19H2	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432258 (N-[1-(3-Methoxyphenyl)-1H-pyrazol-3-yl]-N-[1-(pyri...) Show SMILES COc1cccc(c1)-n1ccc(n1)N(C1CCN(Cc2ccccn2)CC1)C(=O)c1cccs1 Show InChI InChI=1S/C26H27N5O2S/c1-33-23-8-4-7-22(18-23)30-16-12-25(28-30)31(26(32)24-9-5-17-34-24)21-10-14-29(15-11-21)19-20-6-2-3-13-27-20/h2-9,12-13,16-18,21H,10-11,14-15,19H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432269 (N-[6-(4-Methoxyphenyl)pyrazin-2-yl]-N-(1-methylpip...) Show SMILES COc1ccc(cc1)-c1cccc(n1)N(C1CCN(C)CC1)C(=O)c1cccs1 Show InChI InChI=1S/C23H25N3O2S/c1-25-14-12-18(13-15-25)26(23(27)21-6-4-16-29-21)22-7-3-5-20(24-22)17-8-10-19(28-2)11-9-17/h3-11,16,18H,12-15H2,1-2H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432272 (N-(1-benzylpiperidin-4-yl)-N-(1-(4-fluorophenyl)-1...) Show SMILES Fc1ccc(cc1)-n1cc(nn1)N(C1CCN(Cc2ccccc2)CC1)C(=O)c1cccs1 Show InChI InChI=1S/C25H24FN5OS/c26-20-8-10-21(11-9-20)30-18-24(27-28-30)31(25(32)23-7-4-16-33-23)22-12-14-29(15-13-22)17-19-5-2-1-3-6-19/h1-11,16,18,22H,12-15,17H2	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432273 (N-(1-benzylpiperidin-4-yl)-N-(1-phenyl-1H-1,2,3-tr...) Show SMILES O=C(N(C1CCN(Cc2ccccc2)CC1)c1cn(nn1)-c1ccccc1)c1cccs1 Show InChI InChI=1S/C25H25N5OS/c31-25(23-12-7-17-32-23)30(24-19-29(27-26-24)21-10-5-2-6-11-21)22-13-15-28(16-14-22)18-20-8-3-1-4-9-20/h1-12,17,19,22H,13-16,18H2	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432273 (N-(1-benzylpiperidin-4-yl)-N-(1-phenyl-1H-1,2,3-tr...) Show SMILES O=C(N(C1CCN(Cc2ccccc2)CC1)c1cn(nn1)-c1ccccc1)c1cccs1 Show InChI InChI=1S/C25H25N5OS/c31-25(23-12-7-17-32-23)30(24-19-29(27-26-24)21-10-5-2-6-11-21)22-13-15-28(16-14-22)18-20-8-3-1-4-9-20/h1-12,17,19,22H,13-16,18H2	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432288 (N-{(1s,4s)-4-[Benzyl(methyl)amino]cyclohexyl}-N-{1...) Show SMILES CN(Cc1ccccc1)[C@H]1CC[C@H](CC1)N(C(=O)c1cccs1)c1ccn(n1)-c1cccc(c1)-c1nnc(C)o1 |r,wU:12.16,9.9,(4.05,1.14,;3.65,2.63,;4.74,3.72,;6.22,3.32,;6.62,1.83,;8.11,1.44,;9.2,2.52,;8.8,4.01,;7.31,4.41,;2.16,3.03,;1.07,1.94,;-.42,2.34,;-.82,3.83,;.27,4.92,;1.76,4.52,;-2.3,4.23,;-2.7,5.71,;-1.61,6.8,;-4.19,6.11,;-5.09,4.87,;-6.56,5.34,;-6.56,6.88,;-5.09,7.36,;-3.39,3.14,;-4.93,3.14,;-5.41,1.67,;-4.16,.77,;-2.92,1.67,;-4.16,-.77,;-2.83,-1.54,;-2.83,-3.08,;-4.16,-3.85,;-5.5,-3.08,;-5.5,-1.54,;-6.83,-3.85,;-8.29,-3.38,;-9.2,-4.62,;-8.29,-5.87,;-8.69,-7.36,;-6.83,-5.39,)| Show InChI InChI=1S/C31H32N6O2S/c1-22-32-33-30(39-22)24-10-6-11-27(20-24)36-18-17-29(34-36)37(31(38)28-12-7-19-40-28)26-15-13-25(14-16-26)35(2)21-23-8-4-3-5-9-23/h3-12,17-20,25-26H,13-16,21H2,1-2H3/t25-,26+	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432289 (N-{(1r,4r)-4-[Benzyl(methyl)amino]cyclohexyl}-3-hy...) Show SMILES CN(Cc1ccccc1)[C@H]1CC[C@@H](CC1)N(C(=O)c1cccc(O)c1)c1ccn(n1)-c1cccc(c1)-c1nnc(C)o1 |r,wU:12.16,wD:9.9,(4.05,.08,;3.65,1.57,;4.74,2.66,;6.22,2.26,;6.62,.77,;8.11,.37,;9.2,1.46,;8.8,2.95,;7.31,3.35,;2.16,1.97,;1.76,3.45,;.27,3.85,;-.82,2.76,;-.42,1.28,;1.07,.88,;-2.3,3.16,;-2.7,4.65,;-1.61,5.74,;-4.19,5.05,;-5.28,3.96,;-6.77,4.36,;-7.16,5.84,;-6.07,6.93,;-6.47,8.42,;-4.59,6.53,;-3.39,2.07,;-4.93,2.07,;-5.41,.61,;-4.16,-.3,;-2.92,.61,;-4.16,-1.84,;-2.83,-2.61,;-2.83,-4.15,;-4.16,-4.92,;-5.5,-4.15,;-5.5,-2.61,;-6.83,-4.92,;-8.29,-4.44,;-9.2,-5.69,;-8.29,-6.93,;-8.69,-8.42,;-6.83,-6.46,)| Show InChI InChI=1S/C33H34N6O3/c1-23-34-35-32(42-23)25-10-6-12-29(20-25)38-19-18-31(36-38)39(33(41)26-11-7-13-30(40)21-26)28-16-14-27(15-17-28)37(2)22-24-8-4-3-5-9-24/h3-13,18-21,27-28,40H,14-17,22H2,1-2H3/t27-,28-	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432290 (N-{(1s,4s)-4-[Benzyl(methyl)amino]cyclohexyl}-3-hy...) Show SMILES CN(Cc1ccccc1)[C@H]1CC[C@H](CC1)N(C(=O)c1cccc(O)c1)c1ccn(n1)-c1cccc(c1)-c1nnc(C)o1 |r,wU:12.16,9.9,(4.05,.08,;3.65,1.57,;4.74,2.66,;6.22,2.26,;6.62,.77,;8.11,.37,;9.2,1.46,;8.8,2.95,;7.31,3.35,;2.16,1.97,;1.07,.88,;-.42,1.28,;-.82,2.76,;.27,3.85,;1.76,3.45,;-2.3,3.16,;-2.7,4.65,;-1.61,5.74,;-4.19,5.05,;-5.28,3.96,;-6.77,4.36,;-7.16,5.84,;-6.07,6.93,;-6.47,8.42,;-4.59,6.53,;-3.39,2.07,;-4.93,2.07,;-5.41,.61,;-4.16,-.3,;-2.92,.61,;-4.16,-1.84,;-2.83,-2.61,;-2.83,-4.15,;-4.16,-4.92,;-5.5,-4.15,;-5.5,-2.61,;-6.83,-4.92,;-8.29,-4.44,;-9.2,-5.69,;-8.29,-6.93,;-8.69,-8.42,;-6.83,-6.46,)| Show InChI InChI=1S/C33H34N6O3/c1-23-34-35-32(42-23)25-10-6-12-29(20-25)38-19-18-31(36-38)39(33(41)26-11-7-13-30(40)21-26)28-16-14-27(15-17-28)37(2)22-24-8-4-3-5-9-24/h3-13,18-21,27-28,40H,14-17,22H2,1-2H3/t27-,28+	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432137 (N-(1-Benzylpiperidin-4-yl)-N-[1-(4-fluorophenyl)-1...) Show SMILES Fc1ccc(cc1)-n1ccc(n1)N(C1CCN(Cc2ccccc2)CC1)C(=O)c1ccoc1 Show InChI InChI=1S/C26H25FN4O2/c27-22-6-8-23(9-7-22)30-16-12-25(28-30)31(26(32)21-13-17-33-19-21)24-10-14-29(15-11-24)18-20-4-2-1-3-5-20/h1-9,12-13,16-17,19,24H,10-11,14-15,18H2	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432138 (N-(1-Benzylpiperidin-4-yl)-N-[1-(4-fluorophenyl)-1...) Show SMILES Fc1ccc(cc1)-n1ccc(n1)N(C1CCN(Cc2ccccc2)CC1)C(=O)c1nccs1 Show InChI InChI=1S/C25H24FN5OS/c26-20-6-8-21(9-7-20)30-16-12-23(28-30)31(25(32)24-27-13-17-33-24)22-10-14-29(15-11-22)18-19-4-2-1-3-5-19/h1-9,12-13,16-17,22H,10-11,14-15,18H2	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432139 (N-(1-Benzylpiperidin-4-yl)-N-[1-(4-fluorophenyl)-1...) Show SMILES Cn1cccc1C(=O)N(C1CCN(Cc2ccccc2)CC1)c1ccn(n1)-c1ccc(F)cc1 Show InChI InChI=1S/C27H28FN5O/c1-30-16-5-8-25(30)27(34)33(26-15-19-32(29-26)23-11-9-22(28)10-12-23)24-13-17-31(18-14-24)20-21-6-3-2-4-7-21/h2-12,15-16,19,24H,13-14,17-18,20H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432142 (N-[1-(4-Fluorophenyl)-1H-pyrazol-3-yl]-N-(1-phenet...) Show SMILES Fc1ccc(cc1)-n1ccc(n1)N(C1CCN(CCc2ccccc2)CC1)C(=O)c1cccs1 Show InChI InChI=1S/C27H27FN4OS/c28-22-8-10-23(11-9-22)31-19-15-26(29-31)32(27(33)25-7-4-20-34-25)24-13-17-30(18-14-24)16-12-21-5-2-1-3-6-21/h1-11,15,19-20,24H,12-14,16-18H2	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432143 (N-[1-(4-Fluorophenyl)-1H-pyrazol-3-yl]-N-(1-phenet...) Show SMILES Fc1ccc(cc1)-n1ccc(n1)N(C1CCN(CCc2ccccc2)CC1)C(=O)c1ccno1 Show InChI InChI=1S/C26H26FN5O2/c27-21-6-8-22(9-7-21)31-19-14-25(29-31)32(26(33)24-10-15-28-34-24)23-12-17-30(18-13-23)16-11-20-4-2-1-3-5-20/h1-10,14-15,19,23H,11-13,16-18H2	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432145 (N-(1-Benzylpiperidin-4-yl)-N-[6-(4-fluorophenyl)py...) Show SMILES Fc1ccc(cc1)-c1cncc(n1)N(C1CCN(Cc2ccccc2)CC1)C(=O)c1cccs1 Show InChI InChI=1S/C27H25FN4OS/c28-22-10-8-21(9-11-22)24-17-29-18-26(30-24)32(27(33)25-7-4-16-34-25)23-12-14-31(15-13-23)19-20-5-2-1-3-6-20/h1-11,16-18,23H,12-15,19H2	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432146 (N-(1-Benzylpiperidin-4-yl)-N-(6-phenylpyrazin-2-yl...) Show SMILES O=C(N(C1CCN(Cc2ccccc2)CC1)c1cncc(n1)-c1ccccc1)c1cccs1 Show InChI InChI=1S/C27H26N4OS/c32-27(25-12-7-17-33-25)31(26-19-28-18-24(29-26)22-10-5-2-6-11-22)23-13-15-30(16-14-23)20-21-8-3-1-4-9-21/h1-12,17-19,23H,13-16,20H2	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432147 (N-(1-Benzylpiperidin-4-yl)-N-[6-(4-ethoxyphenyl)py...) Show SMILES CCOc1ccc(cc1)-c1cncc(n1)N(C1CCN(Cc2ccccc2)CC1)C(=O)c1cccs1 Show InChI InChI=1S/C29H30N4O2S/c1-2-35-25-12-10-23(11-13-25)26-19-30-20-28(31-26)33(29(34)27-9-6-18-36-27)24-14-16-32(17-15-24)21-22-7-4-3-5-8-22/h3-13,18-20,24H,2,14-17,21H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432148 (N-(1-Benzylpiperidin-4-yl)-N-[1-(4-ethoxyphenyl)-1...) Show SMILES CCOc1ccc(cc1)-n1ccc(n1)N(C1CCN(Cc2ccccc2)CC1)C(=O)c1cccs1 Show InChI InChI=1S/C28H30N4O2S/c1-2-34-25-12-10-23(11-13-25)31-19-16-27(29-31)32(28(33)26-9-6-20-35-26)24-14-17-30(18-15-24)21-22-7-4-3-5-8-22/h3-13,16,19-20,24H,2,14-15,17-18,21H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432149 (N-(1-Benzylpiperidin-4-yl)-N-[1-(4-ethoxyphenyl)-1...) Show SMILES CCOc1ccc(cc1)-n1ccc(n1)N(C1CCN(Cc2ccccc2)CC1)C(=O)c1nccs1 Show InChI InChI=1S/C27H29N5O2S/c1-2-34-24-10-8-22(9-11-24)31-18-14-25(29-31)32(27(33)26-28-15-19-35-26)23-12-16-30(17-13-23)20-21-6-4-3-5-7-21/h3-11,14-15,18-19,23H,2,12-13,16-17,20H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432150 (N-(1-Phenethylpiperidin-4-yl)-N-(1-phenyl-1H-pyraz...) Show SMILES O=C(N(C1CCN(CCc2ccccc2)CC1)c1ccn(n1)-c1ccccc1)c1cccs1 Show InChI InChI=1S/C27H28N4OS/c32-27(25-12-7-21-33-25)31(26-16-20-30(28-26)23-10-5-2-6-11-23)24-14-18-29(19-15-24)17-13-22-8-3-1-4-9-22/h1-12,16,20-21,24H,13-15,17-19H2	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432151 (N-(1-Benzylpiperidin-4-yl)-N-(1-phenyl-1H-pyrazol-...) Show SMILES O=C(N(C1CCN(Cc2ccccc2)CC1)c1ccn(n1)-c1ccccc1)c1cccs1 Show InChI InChI=1S/C26H26N4OS/c31-26(24-12-7-19-32-24)30(25-15-18-29(27-25)22-10-5-2-6-11-22)23-13-16-28(17-14-23)20-21-8-3-1-4-9-21/h1-12,15,18-19,23H,13-14,16-17,20H2	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432152 (N-(1-Benzylpiperidin-4-yl)-N-(1-phenyl-1H-pyrazol-...) Show SMILES O=C(N(C1CCN(Cc2ccccc2)CC1)c1ccn(n1)-c1ccccc1)c1ccco1 Show InChI InChI=1S/C26H26N4O2/c31-26(24-12-7-19-32-24)30(25-15-18-29(27-25)22-10-5-2-6-11-22)23-13-16-28(17-14-23)20-21-8-3-1-4-9-21/h1-12,15,18-19,23H,13-14,16-17,20H2	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432153 (N-(1-Benzylpiperidin-4-yl)-N-(1-phenyl-1H-pyrazol-...) Show SMILES O=C(N(C1CCN(Cc2ccccc2)CC1)c1ccn(n1)-c1ccccc1)c1nccs1 Show InChI InChI=1S/C25H25N5OS/c31-25(24-26-14-18-32-24)30(23-13-17-29(27-23)21-9-5-2-6-10-21)22-11-15-28(16-12-22)19-20-7-3-1-4-8-20/h1-10,13-14,17-18,22H,11-12,15-16,19H2	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432185 (N-(1-phenethylpiperidin-4-yl)-N-(1-phenyl-1H-1,2,4...) Show SMILES O=C(N(C1CCN(CCc2ccccc2)CC1)c1ncn(n1)-c1ccccc1)c1cccs1 Show InChI InChI=1S/C26H27N5OS/c32-25(24-12-7-19-33-24)31(26-27-20-30(28-26)22-10-5-2-6-11-22)23-14-17-29(18-15-23)16-13-21-8-3-1-4-9-21/h1-12,19-20,23H,13-18H2	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432187 (N-(1-Benzylpiperidin-4-yl)-3-hydroxy-N-{1-[3-(5-me...) Show SMILES Cc1nnc(o1)-c1cccc(c1)-n1ccc(n1)N(C1CCN(Cc2ccccc2)CC1)C(=O)c1cccc(O)c1 Show InChI InChI=1S/C31H30N6O3/c1-22-32-33-30(40-22)24-9-5-11-27(19-24)36-18-15-29(34-36)37(31(39)25-10-6-12-28(38)20-25)26-13-16-35(17-14-26)21-23-7-3-2-4-8-23/h2-12,15,18-20,26,38H,13-14,16-17,21H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432190 (N-(2-Benzylpiperidin-4-yl)-N-(1-phenyl-1H-pyrazol-...) Show SMILES O=C(N(C1CCNC(Cc2ccccc2)C1)c1ccn(n1)-c1ccccc1)c1cccs1 Show InChI InChI=1S/C26H26N4OS/c31-26(24-12-7-17-32-24)30(25-14-16-29(28-25)22-10-5-2-6-11-22)23-13-15-27-21(19-23)18-20-8-3-1-4-9-20/h1-12,14,16-17,21,23,27H,13,15,18-19H2	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432191 (N-[2-(Benzylamino)ethyl]-N-(1-phenyl-1H-pyrazol-3-...) Show SMILES O=C(N(CCNCc1ccccc1)c1ccn(n1)-c1ccccc1)c1cccs1 Show InChI InChI=1S/C23H22N4OS/c28-23(21-12-7-17-29-21)26(16-14-24-18-19-8-3-1-4-9-19)22-13-15-27(25-22)20-10-5-2-6-11-20/h1-13,15,17,24H,14,16,18H2	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432192 (N-[3-(Benzylamino)propyl]-N-(1-phenyl-1H-pyrazol-3...) Show SMILES O=C(N(CCCNCc1ccccc1)c1ccn(n1)-c1ccccc1)c1cccs1 Show InChI InChI=1S/C24H24N4OS/c29-24(22-13-7-18-30-22)27(16-8-15-25-19-20-9-3-1-4-10-20)23-14-17-28(26-23)21-11-5-2-6-12-21/h1-7,9-14,17-18,25H,8,15-16,19H2	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432193 (N-[2-(Methylamino)ethyl]-N-(1-phenyl-1H-pyrazol-3-...) Show SMILES CNCCN(C(=O)c1cccs1)c1ccn(n1)-c1ccccc1 Show InChI InChI=1S/C17H18N4OS/c1-18-10-12-20(17(22)15-8-5-13-23-15)16-9-11-21(19-16)14-6-3-2-4-7-14/h2-9,11,13,18H,10,12H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432194 (N-(1-Isobutylpiperidin-4-yl)-N-(1-phenyl-1H-pyrazo...) Show SMILES CC(C)CN1CCC(CC1)N(C(=O)c1cccs1)c1ccn(n1)-c1ccccc1 Show InChI InChI=1S/C23H28N4OS/c1-18(2)17-25-13-10-20(11-14-25)27(23(28)21-9-6-16-29-21)22-12-15-26(24-22)19-7-4-3-5-8-19/h3-9,12,15-16,18,20H,10-11,13-14,17H2,1-2H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432197 (N-{2-[Benzyl(methyl)amino]ethyl}-N-(1-phenyl-1H-py...) Show SMILES CN(CCN(C(=O)c1cccs1)c1ccn(n1)-c1ccccc1)Cc1ccccc1 Show InChI InChI=1S/C24H24N4OS/c1-26(19-20-9-4-2-5-10-20)16-17-27(24(29)22-13-8-18-30-22)23-14-15-28(25-23)21-11-6-3-7-12-21/h2-15,18H,16-17,19H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432198 (N-{3-[Benzyl(methyl)amino]propyl}-N-(1-phenyl-1H-p...) Show SMILES CN(CCCN(C(=O)c1cccs1)c1ccn(n1)-c1ccccc1)Cc1ccccc1 Show InChI InChI=1S/C25H26N4OS/c1-27(20-21-10-4-2-5-11-21)16-9-17-28(25(30)23-14-8-19-31-23)24-15-18-29(26-24)22-12-6-3-7-13-22/h2-8,10-15,18-19H,9,16-17,20H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432215 (N-(1-Benzylpiperidin-4-yl)-N-[1-(pyridin-4-yl)-1H-...) Show SMILES O=C(N(C1CCN(Cc2ccccc2)CC1)c1ccn(n1)-c1ccncc1)c1cccs1 Show InChI InChI=1S/C25H25N5OS/c31-25(23-7-4-18-32-23)30(24-12-17-29(27-24)21-8-13-26-14-9-21)22-10-15-28(16-11-22)19-20-5-2-1-3-6-20/h1-9,12-14,17-18,22H,10-11,15-16,19H2	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432216 (N-(1-Benzylpiperidin-4-yl)-N-[1-(pyridin-3-yl)-1H-...) Show SMILES O=C(N(C1CCN(Cc2ccccc2)CC1)c1ccn(n1)-c1cccnc1)c1cccs1 Show InChI InChI=1S/C25H25N5OS/c31-25(23-9-5-17-32-23)30(24-12-16-29(27-24)22-8-4-13-26-18-22)21-10-14-28(15-11-21)19-20-6-2-1-3-7-20/h1-9,12-13,16-18,21H,10-11,14-15,19H2	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432217 (N-(1-Benzylpiperidin-4-yl)-N-[1-(pyridin-2-yl)-1H-...) Show SMILES O=C(N(C1CCN(Cc2ccccc2)CC1)c1ccn(n1)-c1ccccn1)c1cccs1 Show InChI InChI=1S/C25H25N5OS/c31-25(22-9-6-18-32-22)30(24-13-17-29(27-24)23-10-4-5-14-26-23)21-11-15-28(16-12-21)19-20-7-2-1-3-8-20/h1-10,13-14,17-18,21H,11-12,15-16,19H2	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432219 (N-(1-Benzylpiperidin-4-yl)-N-[1-(3-fluoropyridin-4...) Show SMILES Fc1cnccc1-n1ccc(n1)N(C1CCN(Cc2ccccc2)CC1)C(=O)c1cccs1 Show InChI InChI=1S/C25H24FN5OS/c26-21-17-27-12-8-22(21)30-15-11-24(28-30)31(25(32)23-7-4-16-33-23)20-9-13-29(14-10-20)18-19-5-2-1-3-6-19/h1-8,11-12,15-17,20H,9-10,13-14,18H2	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432220 (N-(1-Benzylpiperidin-4-yl)-N-[1-(3-chloropyridin-4...) Show SMILES Clc1cnccc1-n1ccc(n1)N(C1CCN(Cc2ccccc2)CC1)C(=O)c1cccs1 Show InChI InChI=1S/C25H24ClN5OS/c26-21-17-27-12-8-22(21)30-15-11-24(28-30)31(25(32)23-7-4-16-33-23)20-9-13-29(14-10-20)18-19-5-2-1-3-6-19/h1-8,11-12,15-17,20H,9-10,13-14,18H2	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432248 (3-Hydroxy-N-[1-(3-methoxyphenyl)-1H-pyrazol-3-yl]-...) Show SMILES COc1cccc(c1)-n1ccc(n1)N(C1CCN(C)CC1)C(=O)c1cccc(O)c1 Show InChI InChI=1S/C23H26N4O3/c1-25-12-9-18(10-13-25)27(23(29)17-5-3-7-20(28)15-17)22-11-14-26(24-22)19-6-4-8-21(16-19)30-2/h3-8,11,14-16,18,28H,9-10,12-13H2,1-2H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Voltage-dependent calcium channel subunit alpha-2/delta-1 (Homo sapiens (Human))	BDBM432250 (N-{1-[3-(5-Methyl-1,3,4-oxadiazol-2-yl)phenyl]-1H-...) Show SMILES CN1CCC(CC1)N(C(=O)c1cccs1)c1ccn(n1)-c1cccc(c1)-c1nnc(C)o1 Show InChI InChI=1S/C23H24N6O2S/c1-16-24-25-22(31-16)17-5-3-6-19(15-17)28-13-10-21(26-28)29(18-8-11-27(2)12-9-18)23(30)20-7-4-14-32-20/h3-7,10,13-15,18H,8-9,11-12H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description Human α2δ-1 enriched membranes (2.5 μg) were incubated with 15 nM of radiolabeled [3H]-Gabapentin in assay buffer containing Hepes-KOH...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432253 (N-(1-Benzylpiperidin-4-yl)-N-[1-(4-cyanophenyl)-1H...) Show SMILES O=C(N(C1CCN(Cc2ccccc2)CC1)c1ccn(n1)-c1ccc(cc1)C#N)c1cccs1 Show InChI InChI=1S/C27H25N5OS/c28-19-21-8-10-23(11-9-21)31-17-14-26(29-31)32(27(33)25-7-4-18-34-25)24-12-15-30(16-13-24)20-22-5-2-1-3-6-22/h1-11,14,17-18,24H,12-13,15-16,20H2	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432254 (N-(1-Benzylpiperidin-4-yl)-N-[1-(3-cyanophenyl)-1H...) Show SMILES O=C(N(C1CCN(Cc2ccccc2)CC1)c1ccn(n1)-c1cccc(c1)C#N)c1cccs1 Show InChI InChI=1S/C27H25N5OS/c28-19-22-8-4-9-24(18-22)31-16-13-26(29-31)32(27(33)25-10-5-17-34-25)23-11-14-30(15-12-23)20-21-6-2-1-3-7-21/h1-10,13,16-18,23H,11-12,14-15,20H2	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432256 (N-(1-Benzylpiperidin-4-yl)-N-[1-(3-fluorophenyl)-1...) Show SMILES Fc1cccc(c1)-n1ccc(n1)N(C1CCN(Cc2ccccc2)CC1)C(=O)c1cccs1 Show InChI InChI=1S/C26H25FN4OS/c27-21-8-4-9-23(18-21)30-16-13-25(28-30)31(26(32)24-10-5-17-33-24)22-11-14-29(15-12-22)19-20-6-2-1-3-7-20/h1-10,13,16-18,22H,11-12,14-15,19H2	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432135 (N-(1-Benzylpiperidin-4-yl)-N-[1-(4-fluorophenyl)-1...) Show SMILES Fc1ccc(cc1)-n1ccc(n1)N(C1CCN(Cc2ccccc2)CC1)C(=O)c1ccco1 Show InChI InChI=1S/C26H25FN4O2/c27-21-8-10-22(11-9-21)30-17-14-25(28-30)31(26(32)24-7-4-18-33-24)23-12-15-29(16-13-23)19-20-5-2-1-3-6-20/h1-11,14,17-18,23H,12-13,15-16,19H2	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	<100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432278 (3-(1H-Imidazol-2-yl)-N-{1-[3-(5-methyl-1,3,4-oxadi...) Show SMILES CN1CCC(CC1)N(C(=O)c1cccc(c1)-c1ncc[nH]1)c1ccn(n1)-c1cccc(c1)-c1nnc(C)o1 Show InChI InChI=1S/C28H28N8O2/c1-19-31-32-27(38-19)21-6-4-8-24(18-21)35-16-11-25(33-35)36(23-9-14-34(2)15-10-23)28(37)22-7-3-5-20(17-22)26-29-12-13-30-26/h3-8,11-13,16-18,23H,9-10,14-15H2,1-2H3,(H,29,30)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	300	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Voltage-dependent calcium channel subunit alpha-2/delta-1 (Homo sapiens (Human))	BDBM432267 (N-{6-[3-(5-Methyl-1,3,4-oxadiazol-2-yl)phenyl]pyri...) Show SMILES CN1CCC(CC1)N(C(=O)c1cccs1)c1cccc(n1)-c1cccc(c1)-c1nnc(C)o1 Show InChI InChI=1S/C25H25N5O2S/c1-17-27-28-24(32-17)19-7-3-6-18(16-19)21-8-4-10-23(26-21)30(20-11-13-29(2)14-12-20)25(31)22-9-5-15-33-22/h3-10,15-16,20H,11-14H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	300	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description Human α2δ-1 enriched membranes (2.5 μg) were incubated with 15 nM of radiolabeled [3H]-Gabapentin in assay buffer containing Hepes-KOH...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432136 (N-(1-Benzylpiperidin-4-yl)-N-[1-(4-fluorophenyl)-1...) Show SMILES Fc1ccc(cc1)-n1ccc(n1)N(C1CCN(Cc2ccccc2)CC1)C(=O)c1ccno1 Show InChI InChI=1S/C25H24FN5O2/c26-20-6-8-21(9-7-20)30-17-13-24(28-30)31(25(32)23-10-14-27-33-23)22-11-15-29(16-12-22)18-19-4-2-1-3-5-19/h1-10,13-14,17,22H,11-12,15-16,18H2	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	300	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432141 (N-(1-Benzylpiperidin-4-yl)-N-[1-(4-fluorophenyl)-1...) Show SMILES Fc1ccc(cc1)-n1ccc(n1)N(C1CCN(Cc2ccccc2)CC1)C(=O)c1cnco1 Show InChI InChI=1S/C25H24FN5O2/c26-20-6-8-21(9-7-20)30-15-12-24(28-30)31(25(32)23-16-27-18-33-23)22-10-13-29(14-11-22)17-19-4-2-1-3-5-19/h1-9,12,15-16,18,22H,10-11,13-14,17H2	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	300	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432144 (N-(1-Benzylpiperidin-4-yl)-N-[5-(4-fluorophenyl)py...) Show SMILES Fc1ccc(cc1)-c1cnc(cn1)N(C1CCN(Cc2ccccc2)CC1)C(=O)c1cccs1 Show InChI InChI=1S/C27H25FN4OS/c28-22-10-8-21(9-11-22)24-17-30-26(18-29-24)32(27(33)25-7-4-16-34-25)23-12-14-31(15-13-23)19-20-5-2-1-3-6-20/h1-11,16-18,23H,12-15,19H2	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	300	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432154 (N-(1-Benzylpiperidin-4-yl)-N-(1-phenyl-1H-pyrazol-...) Show SMILES O=C(N(C1CCN(Cc2ccccc2)CC1)c1ccn(n1)-c1ccccc1)c1ccccn1 Show InChI InChI=1S/C27H27N5O/c33-27(25-13-7-8-17-28-25)32(26-16-20-31(29-26)23-11-5-2-6-12-23)24-14-18-30(19-15-24)21-22-9-3-1-4-10-22/h1-13,16-17,20,24H,14-15,18-19,21H2	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	300	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM432156 (N-(1-Benzylpiperidin-4-yl)-5-fluoro-N-(1-phenyl-1H...) Show SMILES Fc1ccc(s1)C(=O)N(C1CCN(Cc2ccccc2)CC1)c1ccn(n1)-c1ccccc1 Show InChI InChI=1S/C26H25FN4OS/c27-24-12-11-23(33-24)26(32)31(25-15-18-30(28-25)21-9-5-2-6-10-21)22-13-16-29(17-14-22)19-20-7-3-1-4-8-20/h1-12,15,18,22H,13-14,16-17,19H2	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	300	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
ESTEVE PHARMACEUTICALS, S.A. US Patent					Assay Description To investigate binding properties of test compounds to human μ-opioid receptor, transfected CHO-K1 cell membranes and [3H]-DAMGO (Perkin Elmer, ...				US Patent US10577360 (2020) BindingDB Entry DOI: 10.7270/Q2MC92DM
					More data for this Ligand-Target Pair

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