Compile Data Set for Download or QSAR

Found 194 hits with Last Name = 'besada' and Initial = 'p'   

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
Adenosine receptor A1 (Rattus norvegicus (rat))	BDBM50370447 (CHEMBL609341) Show SMILES CCNC(=O)[C@H]1OC([C@H](O)[C@@H]1O)n1cnc2c(NC(=O)c3ccc(Cl)cc3Cl)ncnc12 |r| Show InChI InChI=1S/C19H18Cl2N6O5/c1-2-22-18(31)14-12(28)13(29)19(32-14)27-7-25-11-15(23-6-24-16(11)27)26-17(30)9-4-3-8(20)5-10(9)21/h3-7,12-14,19,28-29H,2H2,1H3,(H,22,31)(H,23,24,26,30)/t12-,13+,14-,19?/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	16	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Experimental Sugar Cane Station Curated by ChEMBL					Assay Description Inhibition of [3H]R-PIA binding to Adenosine A1 receptor from rat brain membrane				Bioorg Med Chem Lett 15: 2641-5 (2005) Article DOI: 10.1016/j.bmcl.2005.03.028 BindingDB Entry DOI: 10.7270/Q2Z60PTD
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Rattus norvegicus)	BDBM50179030 ((2S,3S,4R,5R)-3,4-Dihydroxy-5-(6-{3-[4-(pyridin-2-...) Show SMILES CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NC(=O)Nc3ccc(cc3)S(=O)(=O)Nc3ccccn3)ncnc12 Show InChI InChI=1S/C24H25N9O7S/c1-2-25-22(36)19-17(34)18(35)23(40-19)33-12-29-16-20(27-11-28-21(16)33)31-24(37)30-13-6-8-14(9-7-13)41(38,39)32-15-5-3-4-10-26-15/h3-12,17-19,23,34-35H,2H2,1H3,(H,25,36)(H,26,32)(H2,27,28,30,31,37)/t17-,18+,19-,23+/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	54.1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Experimental Sugar Cane Station"Villa Clara-Cienfuegos" Curated by ChEMBL					Assay Description Displacement of radioligand [125I]AB-MECA binding at rat A3 receptor expressed in CHO cells				Bioorg Med Chem Lett 15: 3491-5 (2005) Article DOI: 10.1016/j.bmcl.2005.05.122 BindingDB Entry DOI: 10.7270/Q24Q7VRZ
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Rattus norvegicus)	BDBM50179047 (1-(9-((2R,3R,4S,5S)-5-(ethylcarbamoyl)-3,4-dihydro...) Show SMILES CCCOc1ccc(NC(=O)Nc2ncnc3n(cnc23)[C@@H]2O[C@@H]([C@@H](O)[C@H]2O)C(=O)NCC)cc1 Show InChI InChI=1S/C22H27N7O6/c1-3-9-34-13-7-5-12(6-8-13)27-22(33)28-18-14-19(25-10-24-18)29(11-26-14)21-16(31)15(30)17(35-21)20(32)23-4-2/h5-8,10-11,15-17,21,30-31H,3-4,9H2,1-2H3,(H,23,32)(H2,24,25,27,28,33)/t15-,16+,17-,21+/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	107	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Experimental Sugar Cane Station"Villa Clara-Cienfuegos" Curated by ChEMBL					Assay Description Displacement of radioligand [125I]AB-MECA binding at rat A3 receptor expressed in CHO cells				Bioorg Med Chem Lett 15: 3491-5 (2005) Article DOI: 10.1016/j.bmcl.2005.05.122 BindingDB Entry DOI: 10.7270/Q24Q7VRZ
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Rattus norvegicus)	BDBM50370448 (CHEMBL1791443) Show SMILES CCNC(O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NC(=O)Nc3ccc(cc3)S(=O)(=O)Nc3cc(C)on3)ncnc12 |r| Show InChI InChI=1S/C23H27N9O8S/c1-3-24-21(35)18-16(33)17(34)22(39-18)32-10-27-15-19(25-9-26-20(15)32)29-23(36)28-12-4-6-13(7-5-12)41(37,38)31-14-8-11(2)40-30-14/h4-10,16-18,21-22,24,33-35H,3H2,1-2H3,(H,30,31)(H2,25,26,28,29,36)/t16-,17+,18-,21?,22+/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	155	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Experimental Sugar Cane Station"Villa Clara-Cienfuegos" Curated by ChEMBL					Assay Description Displacement of radioligand [125I]AB-MECA binding at rat A3 receptor expressed in CHO cells				Bioorg Med Chem Lett 15: 3491-5 (2005) Article DOI: 10.1016/j.bmcl.2005.05.122 BindingDB Entry DOI: 10.7270/Q24Q7VRZ
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Rattus norvegicus (rat))	BDBM50179047 (1-(9-((2R,3R,4S,5S)-5-(ethylcarbamoyl)-3,4-dihydro...) Show SMILES CCCOc1ccc(NC(=O)Nc2ncnc3n(cnc23)[C@@H]2O[C@@H]([C@@H](O)[C@H]2O)C(=O)NCC)cc1 Show InChI InChI=1S/C22H27N7O6/c1-3-9-34-13-7-5-12(6-8-13)27-22(33)28-18-14-19(25-10-24-18)29(11-26-14)21-16(31)15(30)17(35-21)20(32)23-4-2/h5-8,10-11,15-17,21,30-31H,3-4,9H2,1-2H3,(H,23,32)(H2,24,25,27,28,33)/t15-,16+,17-,21+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	247	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Experimental Sugar Cane Station Curated by ChEMBL					Assay Description Inhibition of [3H]R-PIA binding to Adenosine A1 receptor from rat brain membrane				Bioorg Med Chem Lett 15: 2641-5 (2005) Article DOI: 10.1016/j.bmcl.2005.03.028 BindingDB Entry DOI: 10.7270/Q2Z60PTD
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Rattus norvegicus (rat))	BDBM50179030 ((2S,3S,4R,5R)-3,4-Dihydroxy-5-(6-{3-[4-(pyridin-2-...) Show SMILES CCNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NC(=O)Nc3ccc(cc3)S(=O)(=O)Nc3ccccn3)ncnc12 Show InChI InChI=1S/C24H25N9O7S/c1-2-25-22(36)19-17(34)18(35)23(40-19)33-12-29-16-20(27-11-28-21(16)33)31-24(37)30-13-6-8-14(9-7-13)41(38,39)32-15-5-3-4-10-26-15/h3-12,17-19,23,34-35H,2H2,1H3,(H,25,36)(H,26,32)(H2,27,28,30,31,37)/t17-,18+,19-,23+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	292	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Experimental Sugar Cane Station Curated by ChEMBL					Assay Description Inhibition of [3H]R-PIA binding to Adenosine A1 receptor from rat brain membrane				Bioorg Med Chem Lett 15: 2641-5 (2005) Article DOI: 10.1016/j.bmcl.2005.03.028 BindingDB Entry DOI: 10.7270/Q2Z60PTD
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Rattus norvegicus)	BDBM50370449 (CHEMBL609340) Show SMILES CCNC(=O)[C@@H]1OC([C@@H](O)[C@H]1O)n1cnc2c(NC(=O)Nc3ccc(cc3)S(=O)(=O)Nc3ncccn3)ncnc12 |r| Show InChI InChI=1S/C23H24N10O7S/c1-2-24-20(36)17-15(34)16(35)21(40-17)33-11-29-14-18(27-10-28-19(14)33)31-23(37)30-12-4-6-13(7-5-12)41(38,39)32-22-25-8-3-9-26-22/h3-11,15-17,21,34-35H,2H2,1H3,(H,24,36)(H,25,26,32)(H2,27,28,30,31,37)/t15-,16+,17-,21?/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	405	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Experimental Sugar Cane Station"Villa Clara-Cienfuegos" Curated by ChEMBL					Assay Description Displacement of radioligand [125I]AB-MECA binding at rat A3 receptor expressed in CHO cells				Bioorg Med Chem Lett 15: 3491-5 (2005) Article DOI: 10.1016/j.bmcl.2005.05.122 BindingDB Entry DOI: 10.7270/Q24Q7VRZ
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Rattus norvegicus (rat))	BDBM50370449 (CHEMBL609340) Show SMILES CCNC(=O)[C@@H]1OC([C@@H](O)[C@H]1O)n1cnc2c(NC(=O)Nc3ccc(cc3)S(=O)(=O)Nc3ncccn3)ncnc12 |r| Show InChI InChI=1S/C23H24N10O7S/c1-2-24-20(36)17-15(34)16(35)21(40-17)33-11-29-14-18(27-10-28-19(14)33)31-23(37)30-12-4-6-13(7-5-12)41(38,39)32-22-25-8-3-9-26-22/h3-11,15-17,21,34-35H,2H2,1H3,(H,24,36)(H,25,26,32)(H2,27,28,30,31,37)/t15-,16+,17-,21?/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	725	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Experimental Sugar Cane Station Curated by ChEMBL					Assay Description Inhibition of [3H]R-PIA binding to Adenosine A1 receptor from rat brain membrane				Bioorg Med Chem Lett 15: 2641-5 (2005) Article DOI: 10.1016/j.bmcl.2005.03.028 BindingDB Entry DOI: 10.7270/Q2Z60PTD
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Rattus norvegicus (rat))	BDBM50370448 (CHEMBL1791443) Show SMILES CCNC(O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NC(=O)Nc3ccc(cc3)S(=O)(=O)Nc3cc(C)on3)ncnc12 |r| Show InChI InChI=1S/C23H27N9O8S/c1-3-24-21(35)18-16(33)17(34)22(39-18)32-10-27-15-19(25-9-26-20(15)32)29-23(36)28-12-4-6-13(7-5-12)41(37,38)31-14-8-11(2)40-30-14/h4-10,16-18,21-22,24,33-35H,3H2,1-2H3,(H,30,31)(H2,25,26,28,29,36)/t16-,17+,18-,21?,22+/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	901	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Experimental Sugar Cane Station Curated by ChEMBL					Assay Description Inhibition of [3H]R-PIA binding to Adenosine A1 receptor from rat brain membrane				Bioorg Med Chem Lett 15: 2641-5 (2005) Article DOI: 10.1016/j.bmcl.2005.03.028 BindingDB Entry DOI: 10.7270/Q2Z60PTD
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Rattus norvegicus (rat))	BDBM50372286 (CHEMBL257111) Show SMILES OCC1CC=CC1n1cnc2c(NC3CCCC3)ncnc12 |w:6.7,2.1,c:4| Show InChI InChI=1S/C16H21N5O/c22-8-11-4-3-7-13(11)21-10-19-14-15(17-9-18-16(14)21)20-12-5-1-2-6-12/h3,7,9-13,22H,1-2,4-6,8H2,(H,17,18,20)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Central University of Las Villas Curated by ChEMBL					Assay Description Displacement of [3H]R-N6-phenylisopropyladenosine from adenosine A1 receptor in rat cerebral cortical membrane				Bioorg Med Chem 16: 1658-75 (2008) Article DOI: 10.1016/j.bmc.2007.11.026 BindingDB Entry DOI: 10.7270/Q20C4WMR
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Rattus norvegicus (rat))	BDBM50372288 (CHEMBL272016) Show SMILES CNC(=O)C1CC=CC1n1cnc2c(NCc3ccccc3I)ncnc12 |w:4.3,8.9,c:6| Show InChI InChI=1S/C19H19IN6O/c1-21-19(27)13-6-4-8-15(13)26-11-25-16-17(23-10-24-18(16)26)22-9-12-5-2-3-7-14(12)20/h2-5,7-8,10-11,13,15H,6,9H2,1H3,(H,21,27)(H,22,23,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	8.12E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Central University of Las Villas Curated by ChEMBL					Assay Description Displacement of [3H]R-N6-phenylisopropyladenosine from adenosine A1 receptor in rat cerebral cortical membrane				Bioorg Med Chem 16: 1658-75 (2008) Article DOI: 10.1016/j.bmc.2007.11.026 BindingDB Entry DOI: 10.7270/Q20C4WMR
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Rattus norvegicus (rat))	BDBM50370450 (CHEMBL610601) Show SMILES CCNC(=O)[C@H]1OC([C@H](O)[C@@H]1O)n1cnc2c(NC(=O)Nc3ccc(OC)cc3)nc(nc12)C#CCCc1ccccc1 |r| Show InChI InChI=1S/C30H31N7O6/c1-3-31-28(40)25-23(38)24(39)29(43-25)37-17-32-22-26(36-30(41)33-19-13-15-20(42-2)16-14-19)34-21(35-27(22)37)12-8-7-11-18-9-5-4-6-10-18/h4-6,9-10,13-17,23-25,29,38-39H,3,7,11H2,1-2H3,(H,31,40)(H2,33,34,35,36,41)/t23-,24+,25-,29?/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.44E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Experimental Sugar Cane Station Curated by ChEMBL					Assay Description Inhibition of [3H]R-PIA binding to Adenosine A1 receptor from rat brain membrane				Bioorg Med Chem Lett 15: 2641-5 (2005) Article DOI: 10.1016/j.bmcl.2005.03.028 BindingDB Entry DOI: 10.7270/Q2Z60PTD
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Rattus norvegicus (rat))	BDBM50372285 (CHEMBL257684) Show SMILES OCC1CC=CC1n1cnc2c(NCc3ccccc3I)ncnc12 |w:2.1,6.7,c:4| Show InChI InChI=1S/C18H18IN5O/c19-14-6-2-1-4-12(14)8-20-17-16-18(22-10-21-17)24(11-23-16)15-7-3-5-13(15)9-25/h1-4,6-7,10-11,13,15,25H,5,8-9H2,(H,20,21,22)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.55E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Central University of Las Villas Curated by ChEMBL					Assay Description Displacement of [3H]R-N6-phenylisopropyladenosine from adenosine A1 receptor in rat cerebral cortical membrane				Bioorg Med Chem 16: 1658-75 (2008) Article DOI: 10.1016/j.bmc.2007.11.026 BindingDB Entry DOI: 10.7270/Q20C4WMR
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Rattus norvegicus (rat))	BDBM50372287 (CHEMBL405897) Show SMILES OCC1CC=CC1n1cnc2c(NC3CC3)ncnc12 |w:6.7,2.1,c:4| Show InChI InChI=1S/C14H17N5O/c20-6-9-2-1-3-11(9)19-8-17-12-13(18-10-4-5-10)15-7-16-14(12)19/h1,3,7-11,20H,2,4-6H2,(H,15,16,18)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.23E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Central University of Las Villas Curated by ChEMBL					Assay Description Displacement of [3H]R-N6-phenylisopropyladenosine from adenosine A1 receptor in rat cerebral cortical membrane				Bioorg Med Chem 16: 1658-75 (2008) Article DOI: 10.1016/j.bmc.2007.11.026 BindingDB Entry DOI: 10.7270/Q20C4WMR
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM15579 (CHEMBL972 | DEPRENYL | L-Deprenyl | N-methyl-N-[(2...) Show SMILES C[C@H](Cc1ccccc1)N(C)CC#C |r| Show InChI InChI=1S/C13H17N/c1-4-10-14(3)12(2)11-13-8-6-5-7-9-13/h1,5-9,12H,10-11H2,2-3H3/t12-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de Vigo Curated by ChEMBL					Assay Description Inhibition of human recombinant MAO-B expressed in baculovirus infected BTI-TN5B1-4 cells using p-tyramine as substrate assessed as reduction in H2O2...				Eur J Med Chem 139: 1-11 (2017) Article DOI: 10.1016/j.ejmech.2017.07.045 BindingDB Entry DOI: 10.7270/Q2MC92M9
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50456804 (CHEMBL4215743) Show SMILES COc1ccc2oc(=O)c(cc2c1)-c1ccc(Br)nn1 Show InChI InChI=1S/C14H9BrN2O3/c1-19-9-2-4-12-8(6-9)7-10(14(18)20-12)11-3-5-13(15)17-16-11/h2-7H,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	560	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de Vigo Curated by ChEMBL					Assay Description Inhibition of human recombinant MAO-B expressed in baculovirus infected BTI-TN5B1-4 cells using p-tyramine as substrate assessed as reduction in H2O2...				Eur J Med Chem 139: 1-11 (2017) Article DOI: 10.1016/j.ejmech.2017.07.045 BindingDB Entry DOI: 10.7270/Q2MC92M9
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50456815 (CHEMBL4203878) Show SMILES Cc1ccc2cc(-c3ccc(Br)nn3)c(=O)oc2c1 Show InChI InChI=1S/C14H9BrN2O2/c1-8-2-3-9-7-10(14(18)19-12(9)6-8)11-4-5-13(15)17-16-11/h2-7H,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	750	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de Vigo Curated by ChEMBL					Assay Description Inhibition of human recombinant MAO-B expressed in baculovirus infected BTI-TN5B1-4 cells using p-tyramine as substrate assessed as reduction in H2O2...				Eur J Med Chem 139: 1-11 (2017) Article DOI: 10.1016/j.ejmech.2017.07.045 BindingDB Entry DOI: 10.7270/Q2MC92M9
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50456802 (CHEMBL4208757) Show SMILES Cc1ccc2oc(=O)c(cc2c1)-c1ccc(Br)nn1 Show InChI InChI=1S/C14H9BrN2O2/c1-8-2-4-12-9(6-8)7-10(14(18)19-12)11-3-5-13(15)17-16-11/h2-7H,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.16E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de Vigo Curated by ChEMBL					Assay Description Inhibition of human recombinant MAO-B expressed in baculovirus infected BTI-TN5B1-4 cells using p-tyramine as substrate assessed as reduction in H2O2...				Eur J Med Chem 139: 1-11 (2017) Article DOI: 10.1016/j.ejmech.2017.07.045 BindingDB Entry DOI: 10.7270/Q2MC92M9
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50456811 (CHEMBL4215220) Show SMILES Cc1ccc2cc(-c3ccc(Cl)nn3)c(=O)oc2c1 Show InChI InChI=1S/C14H9ClN2O2/c1-8-2-3-9-7-10(14(18)19-12(9)6-8)11-4-5-13(15)17-16-11/h2-7H,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.51E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de Vigo Curated by ChEMBL					Assay Description Inhibition of human recombinant MAO-B expressed in baculovirus infected BTI-TN5B1-4 cells using p-tyramine as substrate assessed as reduction in H2O2...				Eur J Med Chem 139: 1-11 (2017) Article DOI: 10.1016/j.ejmech.2017.07.045 BindingDB Entry DOI: 10.7270/Q2MC92M9
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50456801 (CHEMBL4202487) Show SMILES Cc1cccc2cc(-c3ccc(Br)nn3)c(=O)oc12 Show InChI InChI=1S/C14H9BrN2O2/c1-8-3-2-4-9-7-10(14(18)19-13(8)9)11-5-6-12(15)17-16-11/h2-7H,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.64E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de Vigo Curated by ChEMBL					Assay Description Inhibition of human recombinant MAO-B expressed in baculovirus infected BTI-TN5B1-4 cells using p-tyramine as substrate assessed as reduction in H2O2...				Eur J Med Chem 139: 1-11 (2017) Article DOI: 10.1016/j.ejmech.2017.07.045 BindingDB Entry DOI: 10.7270/Q2MC92M9
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50456812 (CHEMBL4214681) Show SMILES COc1ccc2cc(-c3ccc(Br)nn3)c(=O)oc2c1 Show InChI InChI=1S/C14H9BrN2O3/c1-19-9-3-2-8-6-10(14(18)20-12(8)7-9)11-4-5-13(15)17-16-11/h2-7H,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.05E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de Vigo Curated by ChEMBL					Assay Description Inhibition of human recombinant MAO-B expressed in baculovirus infected BTI-TN5B1-4 cells using p-tyramine as substrate assessed as reduction in H2O2...				Eur J Med Chem 139: 1-11 (2017) Article DOI: 10.1016/j.ejmech.2017.07.045 BindingDB Entry DOI: 10.7270/Q2MC92M9
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50456803 (CHEMBL4206334) Show SMILES COc1ccc(nn1)-c1cc2cccc(C)c2oc1=O Show InChI InChI=1S/C15H12N2O3/c1-9-4-3-5-10-8-11(15(18)20-14(9)10)12-6-7-13(19-2)17-16-12/h3-8H,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.35E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de Vigo Curated by ChEMBL					Assay Description Inhibition of human recombinant MAO-B expressed in baculovirus infected BTI-TN5B1-4 cells using p-tyramine as substrate assessed as reduction in H2O2...				Eur J Med Chem 139: 1-11 (2017) Article DOI: 10.1016/j.ejmech.2017.07.045 BindingDB Entry DOI: 10.7270/Q2MC92M9
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] A (Homo sapiens (Human))	BDBM29136 (CHEMBL92401 | Euphozid | Iprazid | Iproniazid) Show SMILES CC(C)NNC(=O)c1ccncc1 Show InChI InChI=1S/C9H13N3O/c1-7(2)11-12-9(13)8-3-5-10-6-4-8/h3-7,11H,1-2H3,(H,12,13)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	6.56E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de Vigo Curated by ChEMBL					Assay Description Inhibition of human recombinant MAO-A expressed in baculovirus infected BTI-TN5B1-4 cells using p-tyramine as substrate assessed as reduction in H2O2...				Eur J Med Chem 139: 1-11 (2017) Article DOI: 10.1016/j.ejmech.2017.07.045 BindingDB Entry DOI: 10.7270/Q2MC92M9
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM29136 (CHEMBL92401 | Euphozid | Iprazid | Iproniazid) Show SMILES CC(C)NNC(=O)c1ccncc1 Show InChI InChI=1S/C9H13N3O/c1-7(2)11-12-9(13)8-3-5-10-6-4-8/h3-7,11H,1-2H3,(H,12,13)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	7.54E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de Vigo Curated by ChEMBL					Assay Description Inhibition of human recombinant MAO-B expressed in baculovirus infected BTI-TN5B1-4 cells using p-tyramine as substrate assessed as reduction in H2O2...				Eur J Med Chem 139: 1-11 (2017) Article DOI: 10.1016/j.ejmech.2017.07.045 BindingDB Entry DOI: 10.7270/Q2MC92M9
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50456807 (CHEMBL4210805) Show SMILES COc1ccc2oc(=O)c(cc2c1)-c1ccc(Cl)nn1 Show InChI InChI=1S/C14H9ClN2O3/c1-19-9-2-4-12-8(6-9)7-10(14(18)20-12)11-3-5-13(15)17-16-11/h2-7H,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	8.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de Vigo Curated by ChEMBL					Assay Description Inhibition of human recombinant MAO-B expressed in baculovirus infected BTI-TN5B1-4 cells using p-tyramine as substrate assessed as reduction in H2O2...				Eur J Med Chem 139: 1-11 (2017) Article DOI: 10.1016/j.ejmech.2017.07.045 BindingDB Entry DOI: 10.7270/Q2MC92M9
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50456810 (CHEMBL4218045) Show SMILES COc1ccc2oc(=O)c(cc2c1)-c1ccc(OC)nn1 Show InChI InChI=1S/C15H12N2O4/c1-19-10-3-5-13-9(7-10)8-11(15(18)21-13)12-4-6-14(20-2)17-16-12/h3-8H,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.11E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de Vigo Curated by ChEMBL					Assay Description Inhibition of human recombinant MAO-B expressed in baculovirus infected BTI-TN5B1-4 cells using p-tyramine as substrate assessed as reduction in H2O2...				Eur J Med Chem 139: 1-11 (2017) Article DOI: 10.1016/j.ejmech.2017.07.045 BindingDB Entry DOI: 10.7270/Q2MC92M9
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50456805 (CHEMBL4206008) Show SMILES COc1cccc2cc(-c3ccc(Br)nn3)c(=O)oc12 Show InChI InChI=1S/C14H9BrN2O3/c1-19-11-4-2-3-8-7-9(14(18)20-13(8)11)10-5-6-12(15)17-16-10/h2-7H,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.29E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de Vigo Curated by ChEMBL					Assay Description Inhibition of human recombinant MAO-B expressed in baculovirus infected BTI-TN5B1-4 cells using p-tyramine as substrate assessed as reduction in H2O2...				Eur J Med Chem 139: 1-11 (2017) Article DOI: 10.1016/j.ejmech.2017.07.045 BindingDB Entry DOI: 10.7270/Q2MC92M9
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50456814 (CHEMBL4205833) Show SMILES COc1ccc(nn1)-c1cc2ccc(C)cc2oc1=O Show InChI InChI=1S/C15H12N2O3/c1-9-3-4-10-8-11(15(18)20-13(10)7-9)12-5-6-14(19-2)17-16-12/h3-8H,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.35E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de Vigo Curated by ChEMBL					Assay Description Inhibition of human recombinant MAO-B expressed in baculovirus infected BTI-TN5B1-4 cells using p-tyramine as substrate assessed as reduction in H2O2...				Eur J Med Chem 139: 1-11 (2017) Article DOI: 10.1016/j.ejmech.2017.07.045 BindingDB Entry DOI: 10.7270/Q2MC92M9
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50456806 (CHEMBL4210287) Show SMILES Cc1ccc2oc(=O)c(cc2c1)-c1ccc(Cl)nn1 Show InChI InChI=1S/C14H9ClN2O2/c1-8-2-4-12-9(6-8)7-10(14(18)19-12)11-3-5-13(15)17-16-11/h2-7H,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.35E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de Vigo Curated by ChEMBL					Assay Description Inhibition of human recombinant MAO-B expressed in baculovirus infected BTI-TN5B1-4 cells using p-tyramine as substrate assessed as reduction in H2O2...				Eur J Med Chem 139: 1-11 (2017) Article DOI: 10.1016/j.ejmech.2017.07.045 BindingDB Entry DOI: 10.7270/Q2MC92M9
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50456809 (CHEMBL4202589) Show SMILES COc1ccc(nn1)-c1cc2cc(C)ccc2oc1=O Show InChI InChI=1S/C15H12N2O3/c1-9-3-5-13-10(7-9)8-11(15(18)20-13)12-4-6-14(19-2)17-16-12/h3-8H,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.76E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de Vigo Curated by ChEMBL					Assay Description Inhibition of human recombinant MAO-B expressed in baculovirus infected BTI-TN5B1-4 cells using p-tyramine as substrate assessed as reduction in H2O2...				Eur J Med Chem 139: 1-11 (2017) Article DOI: 10.1016/j.ejmech.2017.07.045 BindingDB Entry DOI: 10.7270/Q2MC92M9
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50456808 (CHEMBL4218157) Show SMILES COc1ccc2cc(-c3ccc(Cl)nn3)c(=O)oc2c1 Show InChI InChI=1S/C14H9ClN2O3/c1-19-9-3-2-8-6-10(14(18)20-12(8)7-9)11-4-5-13(15)17-16-11/h2-7H,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.92E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de Vigo Curated by ChEMBL					Assay Description Inhibition of human recombinant MAO-B expressed in baculovirus infected BTI-TN5B1-4 cells using p-tyramine as substrate assessed as reduction in H2O2...				Eur J Med Chem 139: 1-11 (2017) Article DOI: 10.1016/j.ejmech.2017.07.045 BindingDB Entry DOI: 10.7270/Q2MC92M9
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50456813 (CHEMBL4205924) Show SMILES Cc1cccc2cc(-c3ccc(Cl)nn3)c(=O)oc12 Show InChI InChI=1S/C14H9ClN2O2/c1-8-3-2-4-9-7-10(14(18)19-13(8)9)11-5-6-12(15)17-16-11/h2-7H,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.27E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de Vigo Curated by ChEMBL					Assay Description Inhibition of human recombinant MAO-B expressed in baculovirus infected BTI-TN5B1-4 cells using p-tyramine as substrate assessed as reduction in H2O2...				Eur J Med Chem 139: 1-11 (2017) Article DOI: 10.1016/j.ejmech.2017.07.045 BindingDB Entry DOI: 10.7270/Q2MC92M9
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] B (Homo sapiens (Human))	BDBM50456816 (CHEMBL4206431) Show SMILES COc1cccc2cc(-c3ccc(Cl)nn3)c(=O)oc12 Show InChI InChI=1S/C14H9ClN2O3/c1-19-11-4-2-3-8-7-9(14(18)20-13(8)11)10-5-6-12(15)17-16-10/h2-7H,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.01E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de Vigo Curated by ChEMBL					Assay Description Inhibition of human recombinant MAO-B expressed in baculovirus infected BTI-TN5B1-4 cells using p-tyramine as substrate assessed as reduction in H2O2...				Eur J Med Chem 139: 1-11 (2017) Article DOI: 10.1016/j.ejmech.2017.07.045 BindingDB Entry DOI: 10.7270/Q2MC92M9
					More data for this Ligand-Target Pair
Amine oxidase [flavin-containing] A (Homo sapiens (Human))	BDBM15579 (CHEMBL972 | DEPRENYL | L-Deprenyl | N-methyl-N-[(2...) Show SMILES C[C@H](Cc1ccccc1)N(C)CC#C |r| Show InChI InChI=1S/C13H17N/c1-4-10-14(3)12(2)11-13-8-6-5-7-9-13/h1,5-9,12H,10-11H2,2-3H3/t12-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	6.87E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de Vigo Curated by ChEMBL					Assay Description Inhibition of human recombinant MAO-A expressed in baculovirus infected BTI-TN5B1-4 cells using p-tyramine as substrate assessed as reduction in H2O2...				Eur J Med Chem 139: 1-11 (2017) Article DOI: 10.1016/j.ejmech.2017.07.045 BindingDB Entry DOI: 10.7270/Q2MC92M9
					More data for this Ligand-Target Pair
P2Y purinoceptor 6 (Homo sapiens (Human))	BDBM50194146 ((2R,3S,4R,5R)-1-(5-(diphosphoryloxymethyl)-3-fluor...) Show SMILES O[C@@H]1[C@@H](COP(O)(=O)OP(O)(O)=O)O[C@H]([C@H]1F)n1ccc(=O)[nH]c1=O Show InChI InChI=1S/C9H13FN2O11P2/c10-6-7(14)4(3-21-25(19,20)23-24(16,17)18)22-8(6)12-2-1-5(13)11-9(12)15/h1-2,4,6-8,14H,3H2,(H,19,20)(H,11,13,15)(H2,16,17,18)/t4-,6+,7-,8-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	5.50E+3	n/a	n/a	n/a	n/a
National Institute of Diabetes and Digestive and Kidney Diseases Curated by ChEMBL					Assay Description Agonist activity at human recombinant P2Y6 receptor expressed in 1321N1 cells assessed as PLC-mediated [3H]IP production				J Med Chem 49: 5532-43 (2006) Article DOI: 10.1021/jm060485n BindingDB Entry DOI: 10.7270/Q2ZC83NW
					More data for this Ligand-Target Pair
P2Y purinoceptor 6 (Homo sapiens (Human))	BDBM50118239 (CHEMBL130266 | UDP | Uridine diphosphate | uridine...) Show SMILES O[C@@H]1[C@@H](COP(O)(=O)OP(O)(O)=O)O[C@H]([C@@H]1O)n1ccc(=O)[nH]c1=O |r| Show InChI InChI=1S/C9H14N2O12P2/c12-5-1-2-11(9(15)10-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H,10,12,15)(H2,16,17,18)/t4-,6-,7-,8-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	13	n/a	n/a	n/a	n/a
National Institute of Diabetes and Digestive and Kidney Diseases Curated by ChEMBL					Assay Description Agonist activity at human recombinant P2Y6 receptor expressed in 1321N1 cells assessed as PLC-mediated [3H]IP production				J Med Chem 49: 5532-43 (2006) Article DOI: 10.1021/jm060485n BindingDB Entry DOI: 10.7270/Q2ZC83NW
					More data for this Ligand-Target Pair
P2Y purinoceptor 6 (Homo sapiens (Human))	BDBM50194147 (4-Thio-UDP | CHEMBL384992 | [(2R,3S,4R,5R)-3,4-dih...) Show SMILES O[C@H]1[C@@H](O)[C@@H](O[C@@H]1COP(O)(=O)OP(O)(O)=O)n1ccc(=S)[nH]c1=O Show InChI InChI=1S/C9H14N2O11P2S/c12-6-4(3-20-24(18,19)22-23(15,16)17)21-8(7(6)13)11-2-1-5(25)10-9(11)14/h1-2,4,6-8,12-13H,3H2,(H,18,19)(H,10,14,25)(H2,15,16,17)/t4-,6-,7-,8-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	80	n/a	n/a	n/a	n/a
National Institute of Diabetes and Digestive and Kidney Diseases Curated by ChEMBL					Assay Description Agonist activity at human recombinant P2Y6 receptor expressed in 1321N1 cells assessed as PLC-mediated [3H]IP production				J Med Chem 49: 5532-43 (2006) Article DOI: 10.1021/jm060485n BindingDB Entry DOI: 10.7270/Q2ZC83NW
					More data for this Ligand-Target Pair
P2Y purinoceptor 6 (Homo sapiens (Human))	BDBM50194148 ((2R,3R,4S,5R)-4-(allylthio)-1-(3,4-dihydroxy-5-(di...) Show SMILES O[C@@H]1[C@@H](COP(O)(=O)OP(O)(O)=O)O[C@H]([C@@H]1O)n1ccc(SCC=C)nc1=O Show InChI InChI=1S/C12H18N2O11P2S/c1-2-5-28-8-3-4-14(12(17)13-8)11-10(16)9(15)7(24-11)6-23-27(21,22)25-26(18,19)20/h2-4,7,9-11,15-16H,1,5-6H2,(H,21,22)(H2,18,19,20)/t7-,9-,10-,11-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	560	n/a	n/a	n/a	n/a
National Institute of Diabetes and Digestive and Kidney Diseases Curated by ChEMBL					Assay Description Agonist activity at human recombinant P2Y6 receptor expressed in 1321N1 cells assessed as PLC-mediated [3H]IP production				J Med Chem 49: 5532-43 (2006) Article DOI: 10.1021/jm060485n BindingDB Entry DOI: 10.7270/Q2ZC83NW
					More data for this Ligand-Target Pair
P2Y purinoceptor 6 (Homo sapiens (Human))	BDBM92459 (CHEMBL384759 | GDP | Guanosine Diphosphate) Show SMILES Nc1nc2n(cnc2c(=O)[nH]1)[C@@H]1O[C@H](COP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]1O Show InChI InChI=1S/C10H15N5O11P2/c11-10-13-7-4(8(18)14-10)12-2-15(7)9-6(17)5(16)3(25-9)1-24-28(22,23)26-27(19,20)21/h2-3,5-6,9,16-17H,1H2,(H,22,23)(H2,19,20,21)(H3,11,13,14,18)/t3-,5-,6-,9-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG MMDB PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	4.50E+4	n/a	n/a	n/a	n/a
National Institute of Diabetes and Digestive and Kidney Diseases Curated by ChEMBL					Assay Description Agonist activity at human recombinant P2Y6 receptor expressed in 1321N1 cells assessed as PLC-mediated [3H]IP production				J Med Chem 49: 5532-43 (2006) Article DOI: 10.1021/jm060485n BindingDB Entry DOI: 10.7270/Q2ZC83NW
					More data for this Ligand-Target Pair
P2Y purinoceptor 6 (Homo sapiens (Human))	BDBM50368125 (ADENOSINE DIPHOSPHATE | ADP) Show SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@H](CO[P@@](O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]1O |r| Show InChI InChI=1S/C10H15N5O10P2/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(24-10)1-23-27(21,22)25-26(18,19)20/h2-4,6-7,10,16-17H,1H2,(H,21,22)(H2,11,12,13)(H2,18,19,20)/t4-,6-,7-,10-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase MCE KEGG MMDB PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	6.50E+4	n/a	n/a	n/a	n/a
National Institute of Diabetes and Digestive and Kidney Diseases Curated by ChEMBL					Assay Description Agonist activity at human recombinant P2Y6 receptor expressed in 1321N1 cells assessed as PLC-mediated [3H]IP production				J Med Chem 49: 5532-43 (2006) Article DOI: 10.1021/jm060485n BindingDB Entry DOI: 10.7270/Q2ZC83NW
					More data for this Ligand-Target Pair
P2Y purinoceptor 6 (Homo sapiens (Human))	BDBM50194150 ((1S,3R,4R,5S)-1-(4-hydroxy-1-(diphosphoryloxymethy...) Show SMILES O[C@@H]1[C@@H]2C[C@]2(COP(O)(=O)OP(O)(O)=O)O[C@H]1n1ccc(=O)[nH]c1=O Show InChI InChI=1S/C10H14N2O11P2/c13-6-1-2-12(9(15)11-6)8-7(14)5-3-10(5,22-8)4-21-25(19,20)23-24(16,17)18/h1-2,5,7-8,14H,3-4H2,(H,19,20)(H,11,13,15)(H2,16,17,18)/t5-,7+,8+,10+/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	3.50E+3	n/a	n/a	n/a	n/a
National Institute of Diabetes and Digestive and Kidney Diseases Curated by ChEMBL					Assay Description Agonist activity at human recombinant P2Y6 receptor expressed in 1321N1 cells assessed as PLC-mediated [3H]IP production				J Med Chem 49: 5532-43 (2006) Article DOI: 10.1021/jm060485n BindingDB Entry DOI: 10.7270/Q2ZC83NW
					More data for this Ligand-Target Pair
P2Y purinoceptor 6 (Homo sapiens (Human))	BDBM50194152 ((2R,3R,4S,5R)-1-(3,4-dihydroxy-5-(diphosphoryloxym...) Show SMILES O[C@H]1[C@@H](O)[C@@H](O[C@@H]1COP(O)(=O)OP(O)(O)=O)n1c(I)cc(=O)[nH]c1=O Show InChI InChI=1S/C9H13IN2O12P2/c10-4-1-5(13)11-9(16)12(4)8-7(15)6(14)3(23-8)2-22-26(20,21)24-25(17,18)19/h1,3,6-8,14-15H,2H2,(H,20,21)(H,11,13,16)(H2,17,18,19)/t3-,6-,7-,8-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	15	n/a	n/a	n/a	n/a
National Institute of Diabetes and Digestive and Kidney Diseases Curated by ChEMBL					Assay Description Agonist activity at human recombinant P2Y6 receptor expressed in 1321N1 cells assessed as PLC-mediated [3H]IP production				J Med Chem 49: 5532-43 (2006) Article DOI: 10.1021/jm060485n BindingDB Entry DOI: 10.7270/Q2ZC83NW
					More data for this Ligand-Target Pair
P2Y purinoceptor 6 (Homo sapiens (Human))	BDBM50194153 (5'-CDP | CDP | CHEMBL425252 | Cytidine | Cytidine ...) Show SMILES Nc1ccn([C@@H]2O[C@H](COP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]2O)c(=O)n1 Show InChI InChI=1S/C9H15N3O11P2/c10-5-1-2-12(9(15)11-5)8-7(14)6(13)4(22-8)3-21-25(19,20)23-24(16,17)18/h1-2,4,6-8,13-14H,3H2,(H,19,20)(H2,10,11,15)(H2,16,17,18)/t4-,6-,7-,8-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL KEGG MMDB PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	8.80E+4	n/a	n/a	n/a	n/a
National Institute of Diabetes and Digestive and Kidney Diseases Curated by ChEMBL					Assay Description Agonist activity at human recombinant P2Y6 receptor expressed in 1321N1 cells assessed as PLC-mediated [3H]IP production				J Med Chem 49: 5532-43 (2006) Article DOI: 10.1021/jm060485n BindingDB Entry DOI: 10.7270/Q2ZC83NW
					More data for this Ligand-Target Pair
P2Y purinoceptor 6 (Homo sapiens (Human))	BDBM50194151 (CHEMBL212090 | [(2R,3S,5S)-5-(2,4-dioxo-3,4-dihydr...) Show SMILES O[C@H]1C[C@]2(CC2[C@@H]1COP(O)(=O)OP(O)(O)=O)n1ccc(=O)[nH]c1=O Show InChI InChI=1S/C11H16N2O10P2/c14-8-4-11(13-2-1-9(15)12-10(13)16)3-7(11)6(8)5-22-25(20,21)23-24(17,18)19/h1-2,6-8,14H,3-5H2,(H,20,21)(H,12,15,16)(H2,17,18,19)/t6-,7?,8-,11-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	230	n/a	n/a	n/a	n/a
National Institute of Diabetes and Digestive and Kidney Diseases Curated by ChEMBL					Assay Description Agonist activity at human recombinant P2Y6 receptor expressed in 1321N1 cells assessed as PLC-mediated [3H]IP production				J Med Chem 49: 5532-43 (2006) Article DOI: 10.1021/jm060485n BindingDB Entry DOI: 10.7270/Q2ZC83NW
					More data for this Ligand-Target Pair
P2Y purinoceptor 6 (Homo sapiens (Human))	BDBM50194154 ((2R,3R,4S,5R)-2-(1-(3,4-dihydroxy-5-(diphosphorylo...) Show SMILES O[C@@H]1[C@@H](COP(O)(=O)OP(O)(O)=O)O[C@H]([C@@H]1O)n1ccc(SCC(O)=O)nc1=O Show InChI InChI=1S/C11H16N2O13P2S/c14-7(15)4-29-6-1-2-13(11(18)12-6)10-9(17)8(16)5(25-10)3-24-28(22,23)26-27(19,20)21/h1-2,5,8-10,16-17H,3-4H2,(H,14,15)(H,22,23)(H2,19,20,21)/t5-,8-,9-,10-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.70E+3	n/a	n/a	n/a	n/a
National Institute of Diabetes and Digestive and Kidney Diseases Curated by ChEMBL					Assay Description Agonist activity at human recombinant P2Y6 receptor expressed in 1321N1 cells assessed as PLC-mediated [3H]IP production				J Med Chem 49: 5532-43 (2006) Article DOI: 10.1021/jm060485n BindingDB Entry DOI: 10.7270/Q2ZC83NW
					More data for this Ligand-Target Pair
P2Y purinoceptor 6 (Homo sapiens (Human))	BDBM50194155 ((2R,3R,4S,5R)-2-(1-(3,4-dihydroxy-5-(diphosphorylo...) Show SMILES NC(=O)CSc1ccn([C@@H]2O[C@H](COP(O)(=O)OP(O)(O)=O)[C@@H](O)[C@H]2O)c(=O)n1 Show InChI InChI=1S/C11H17N3O12P2S/c12-6(15)4-29-7-1-2-14(11(18)13-7)10-9(17)8(16)5(25-10)3-24-28(22,23)26-27(19,20)21/h1-2,5,8-10,16-17H,3-4H2,(H2,12,15)(H,22,23)(H2,19,20,21)/t5-,8-,9-,10-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.80E+4	n/a	n/a	n/a	n/a
National Institute of Diabetes and Digestive and Kidney Diseases Curated by ChEMBL					Assay Description Agonist activity at human recombinant P2Y6 receptor expressed in 1321N1 cells assessed as PLC-mediated [3H]IP production				J Med Chem 49: 5532-43 (2006) Article DOI: 10.1021/jm060485n BindingDB Entry DOI: 10.7270/Q2ZC83NW
					More data for this Ligand-Target Pair
P2Y purinoceptor 6 (Homo sapiens (Human))	BDBM50179185 (((2R,3S,5R)-5-(2,4-dioxo-3,4-dihydropyrimidin-1(2H...) Show SMILES O[C@H]1C[C@@H](O[C@@H]1COP(O)(=O)OP(O)(O)=O)n1ccc(=O)[nH]c1=O Show InChI InChI=1S/C9H14N2O11P2/c12-5-3-8(11-2-1-7(13)10-9(11)14)21-6(5)4-20-24(18,19)22-23(15,16)17/h1-2,5-6,8,12H,3-4H2,(H,18,19)(H,10,13,14)(H2,15,16,17)/t5-,6+,8+/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL KEGG MMDB PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	n/a	1.72E+3	n/a	n/a	n/a	n/a
National Institute of Diabetes and Digestive and Kidney Diseases Curated by ChEMBL					Assay Description Agonist activity at human recombinant P2Y6 receptor expressed in 1321N1 cells assessed as PLC-mediated [3H]IP production				J Med Chem 49: 5532-43 (2006) Article DOI: 10.1021/jm060485n BindingDB Entry DOI: 10.7270/Q2ZC83NW
					More data for this Ligand-Target Pair
P2Y purinoceptor 6 (Homo sapiens (Human))	BDBM50194156 ((2R,3R,4S,5R)-4-(benzylthio)-1-(3,4-dihydroxy-5-(d...) Show SMILES O[C@@H]1[C@@H](COP(O)(=O)OP(O)(O)=O)O[C@H]([C@@H]1O)n1ccc(SCc2ccccc2)nc1=O Show InChI InChI=1S/C16H20N2O11P2S/c19-13-11(8-27-31(25,26)29-30(22,23)24)28-15(14(13)20)18-7-6-12(17-16(18)21)32-9-10-4-2-1-3-5-10/h1-7,11,13-15,19-20H,8-9H2,(H,25,26)(H2,22,23,24)/t11-,13-,14-,15-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	800	n/a	n/a	n/a	n/a
National Institute of Diabetes and Digestive and Kidney Diseases Curated by ChEMBL					Assay Description Agonist activity at human recombinant P2Y6 receptor expressed in 1321N1 cells assessed as PLC-mediated [3H]IP production				J Med Chem 49: 5532-43 (2006) Article DOI: 10.1021/jm060485n BindingDB Entry DOI: 10.7270/Q2ZC83NW
					More data for this Ligand-Target Pair
P2Y purinoceptor 6 (Homo sapiens (Human))	BDBM50194157 (CHEMBL378445 | {[(2R,3S,4R,5R)-5-(2,4-dioxo-1,2,3,...) Show SMILES O[C@@H]1[C@@H](COP(O)(=O)OP(O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2ccc(=O)[nH]c2=O)O[C@H]([C@@H]1O)n1ccc(=O)[nH]c1=O |r| Show InChI InChI=1S/C18H24N4O17P2/c23-9-1-3-21(17(29)19-9)15-13(27)11(25)7(37-15)5-35-40(31,32)39-41(33,34)36-6-8-12(26)14(28)16(38-8)22-4-2-10(24)20-18(22)30/h1-4,7-8,11-16,25-28H,5-6H2,(H,31,32)(H,33,34)(H,19,23,29)(H,20,24,30)/t7-,8-,11-,12-,13-,14-,15-,16-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	2.30E+3	n/a	n/a	n/a	n/a
National Institute of Diabetes and Digestive and Kidney Diseases Curated by ChEMBL					Assay Description Agonist activity at human recombinant P2Y6 receptor expressed in 1321N1 cells assessed as PLC-mediated [3H]IP production				J Med Chem 49: 5532-43 (2006) Article DOI: 10.1021/jm060485n BindingDB Entry DOI: 10.7270/Q2ZC83NW
					More data for this Ligand-Target Pair
P2Y purinoceptor 6 (Homo sapiens (Human))	BDBM50194158 ((2R,3R,4S,5R)-3-(1-(3,4-dihydroxy-5-(diphosphorylo...) Show SMILES O[C@@H]1[C@@H](COP(O)(=O)OP(O)(O)=O)O[C@H]([C@@H]1O)n1ccc(SCCC(O)=O)nc1=O Show InChI InChI=1S/C12H18N2O13P2S/c15-8(16)2-4-30-7-1-3-14(12(19)13-7)11-10(18)9(17)6(26-11)5-25-29(23,24)27-28(20,21)22/h1,3,6,9-11,17-18H,2,4-5H2,(H,15,16)(H,23,24)(H2,20,21,22)/t6-,9-,10-,11-/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a
National Institute of Diabetes and Digestive and Kidney Diseases Curated by ChEMBL					Assay Description Agonist activity at human recombinant P2Y6 receptor expressed in 1321N1 cells assessed as PLC-mediated [3H]IP production				J Med Chem 49: 5532-43 (2006) Article DOI: 10.1021/jm060485n BindingDB Entry DOI: 10.7270/Q2ZC83NW
					More data for this Ligand-Target Pair

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