Compile Data Set for Download or QSAR

Found 37 hits with Last Name = 'tervo' and Initial = 'aj'   

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
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50178769 ((+/-)-6-chloro-2,3,4,9-tetrahydro-1H-carbazole-1-c...) Show SMILES NC(=O)C1CCCc2c1[nH]c1ccc(Cl)cc21 Show InChI InChI=1S/C13H13ClN2O/c14-7-4-5-11-10(6-7)8-2-1-3-9(13(15)17)12(8)16-11/h4-6,9,16H,1-3H2,(H2,15,17)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	280	n/a	n/a	n/a	n/a	n/a	n/a
University of Kuopio Curated by ChEMBL					Assay Description Inhibition of SIRT1				Bioorg Med Chem Lett 17: 2448-51 (2007) Article DOI: 10.1016/j.bmcl.2007.02.023 BindingDB Entry DOI: 10.7270/Q2CR5V53
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50178769 ((+/-)-6-chloro-2,3,4,9-tetrahydro-1H-carbazole-1-c...) Show SMILES NC(=O)C1CCCc2c1[nH]c1ccc(Cl)cc21 Show InChI InChI=1S/C13H13ClN2O/c14-7-4-5-11-10(6-7)8-2-1-3-9(13(15)17)12(8)16-11/h4-6,9,16H,1-3H2,(H2,15,17)	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	1.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Kuopio Curated by ChEMBL					Assay Description Inhibition of SIRT2				Bioorg Med Chem Lett 17: 2448-51 (2007) Article DOI: 10.1016/j.bmcl.2007.02.023 BindingDB Entry DOI: 10.7270/Q2CR5V53
					More data for this Ligand-Target Pair				3D Structure (crystal)
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50156760 ((E)-2-((2-hydroxynaphthalen-1-yl)methyleneamino)-N...) Show SMILES CC(NC(=O)c1ccccc1\N=C\c1c(O)ccc2ccccc12)c1ccccc1 Show InChI InChI=1S/C26H22N2O2/c1-18(19-9-3-2-4-10-19)28-26(30)22-13-7-8-14-24(22)27-17-23-21-12-6-5-11-20(21)15-16-25(23)29/h2-18,29H,1H3,(H,28,30)/b27-17+	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	4.51E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Kuopio Curated by ChEMBL					Assay Description Inhibition of SIRT2				J Med Chem 49: 7907-11 (2006) Article DOI: 10.1021/jm060566j BindingDB Entry DOI: 10.7270/Q2G73FHM
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50156760 ((E)-2-((2-hydroxynaphthalen-1-yl)methyleneamino)-N...) Show SMILES CC(NC(=O)c1ccccc1\N=C\c1c(O)ccc2ccccc12)c1ccccc1 Show InChI InChI=1S/C26H22N2O2/c1-18(19-9-3-2-4-10-19)28-26(30)22-13-7-8-14-24(22)27-17-23-21-12-6-5-11-20(21)15-16-25(23)29/h2-18,29H,1H3,(H,28,30)/b27-17+	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	4.51E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Kuopio Curated by ChEMBL					Assay Description Inhibition of human recombinant GST-tagged SIRT2 by histone deacetylase assay				J Med Chem 47: 6292-8 (2004) Article DOI: 10.1021/jm049933m BindingDB Entry DOI: 10.7270/Q2S1820Z
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50241186 ((S)-N-(1-(2-(1H-indol-3-yl)ethylamino)-1-oxopropan...) Show SMILES C[C@H](NC(=O)\C=C\c1ccc(O)cc1)C(=O)NCCc1c[nH]c2ccccc12 |r| Show InChI InChI=1S/C22H23N3O3/c1-15(25-21(27)11-8-16-6-9-18(26)10-7-16)22(28)23-13-12-17-14-24-20-5-3-2-4-19(17)20/h2-11,14-15,24,26H,12-13H2,1H3,(H,23,28)(H,25,27)/b11-8+/t15-/m0/s1	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.70E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Kuopio Curated by ChEMBL					Assay Description Inhibition of SIRT2				Bioorg Med Chem Lett 17: 2448-51 (2007) Article DOI: 10.1016/j.bmcl.2007.02.023 BindingDB Entry DOI: 10.7270/Q2CR5V53
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50241185 ((E)-N-(1-(2-(1H-indol-3-yl)ethylamino)-2-methyl-1-...) Show SMILES CC(C)(NC(=O)\C=C\c1ccc(O)cc1)C(=O)NCCc1c[nH]c2ccccc12 Show InChI InChI=1S/C23H25N3O3/c1-23(2,26-21(28)12-9-16-7-10-18(27)11-8-16)22(29)24-14-13-17-15-25-20-6-4-3-5-19(17)20/h3-12,15,25,27H,13-14H2,1-2H3,(H,24,29)(H,26,28)/b12-9+	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Kuopio Curated by ChEMBL					Assay Description Inhibition of SIRT2				Bioorg Med Chem Lett 17: 2448-51 (2007) Article DOI: 10.1016/j.bmcl.2007.02.023 BindingDB Entry DOI: 10.7270/Q2CR5V53
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50199445 ((E)-N-(2-(5-fluoro-1H-indol-3-yl)ethyl)-4-(3-(4-(4...) Show SMILES Fc1ccc(COc2ccc(\C=C\C(=O)NC3(CCNCC3)C(=O)NCCc3c[nH]c4ccc(F)cc34)cc2)cc1 Show InChI InChI=1S/C32H32F2N4O3/c33-25-6-1-23(2-7-25)21-41-27-9-3-22(4-10-27)5-12-30(39)38-32(14-17-35-18-15-32)31(40)36-16-13-24-20-37-29-11-8-26(34)19-28(24)29/h1-12,19-20,35,37H,13-18,21H2,(H,36,40)(H,38,39)/b12-5+	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Kuopio Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT2				J Med Chem 49: 7239-41 (2006) Article DOI: 10.1021/jm060686r BindingDB Entry DOI: 10.7270/Q2WM1D24
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50199445 ((E)-N-(2-(5-fluoro-1H-indol-3-yl)ethyl)-4-(3-(4-(4...) Show SMILES Fc1ccc(COc2ccc(\C=C\C(=O)NC3(CCNCC3)C(=O)NCCc3c[nH]c4ccc(F)cc34)cc2)cc1 Show InChI InChI=1S/C32H32F2N4O3/c33-25-6-1-23(2-7-25)21-41-27-9-3-22(4-10-27)5-12-30(39)38-32(14-17-35-18-15-32)31(40)36-16-13-24-20-37-29-11-8-26(34)19-28(24)29/h1-12,19-20,35,37H,13-18,21H2,(H,36,40)(H,38,39)/b12-5+	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Kuopio Curated by ChEMBL					Assay Description Inhibition of SIRT2				Bioorg Med Chem Lett 17: 2448-51 (2007) Article DOI: 10.1016/j.bmcl.2007.02.023 BindingDB Entry DOI: 10.7270/Q2CR5V53
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50241183 ((E)-N-(2-(1H-indol-3-yl)ethyl)-4-(3-(4-(benzyloxy)...) Show SMILES O=C(NC1(CCNCC1)C(=O)NCCc1c[nH]c2ccccc12)\C=C\c1ccc(OCc2ccccc2)cc1 Show InChI InChI=1S/C32H34N4O3/c37-30(15-12-24-10-13-27(14-11-24)39-23-25-6-2-1-3-7-25)36-32(17-20-33-21-18-32)31(38)34-19-16-26-22-35-29-9-5-4-8-28(26)29/h1-15,22,33,35H,16-21,23H2,(H,34,38)(H,36,37)/b15-12+	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Kuopio Curated by ChEMBL					Assay Description Inhibition of SIRT1				Bioorg Med Chem Lett 17: 2448-51 (2007) Article DOI: 10.1016/j.bmcl.2007.02.023 BindingDB Entry DOI: 10.7270/Q2CR5V53
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50156763 (1,4-bis(4-hydroxyphenethylamino)anthracene-9,10-di...) Show SMILES Oc1ccc(CCNc2ccc(NCCc3ccc(O)cc3)c3C(=O)c4ccccc4C(=O)c23)cc1 Show InChI InChI=1S/C30H26N2O4/c33-21-9-5-19(6-10-21)15-17-31-25-13-14-26(32-18-16-20-7-11-22(34)12-8-20)28-27(25)29(35)23-3-1-2-4-24(23)30(28)36/h1-14,31-34H,15-18H2	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	5.67E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Kuopio Curated by ChEMBL					Assay Description Inhibition of human recombinant GST-tagged SIRT2 by histone deacetylase assay				J Med Chem 47: 6292-8 (2004) Article DOI: 10.1021/jm049933m BindingDB Entry DOI: 10.7270/Q2S1820Z
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50156763 (1,4-bis(4-hydroxyphenethylamino)anthracene-9,10-di...) Show SMILES Oc1ccc(CCNc2ccc(NCCc3ccc(O)cc3)c3C(=O)c4ccccc4C(=O)c23)cc1 Show InChI InChI=1S/C30H26N2O4/c33-21-9-5-19(6-10-21)15-17-31-25-13-14-26(32-18-16-20-7-11-22(34)12-8-20)28-27(25)29(35)23-3-1-2-4-24(23)30(28)36/h1-14,31-34H,15-18H2	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	5.67E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Kuopio Curated by ChEMBL					Assay Description Inhibition of SIRT2				J Med Chem 49: 7907-11 (2006) Article DOI: 10.1021/jm060566j BindingDB Entry DOI: 10.7270/Q2G73FHM
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50201112 (CHEMBL373990 | N,N'-bis(2-hydroxybenzylidene)benze...) Show SMILES Oc1ccccc1\C=N\c1ccc(cc1)\N=C\c1ccccc1O Show InChI InChI=1S/C20H16N2O2/c23-19-7-3-1-5-15(19)13-21-17-9-11-18(12-10-17)22-14-16-6-2-4-8-20(16)24/h1-14,23-24H/b21-13+,22-14+	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.84E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Kuopio Curated by ChEMBL					Assay Description Inhibition of SIRT2				J Med Chem 49: 7907-11 (2006) Article DOI: 10.1021/jm060566j BindingDB Entry DOI: 10.7270/Q2G73FHM
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50241183 ((E)-N-(2-(1H-indol-3-yl)ethyl)-4-(3-(4-(benzyloxy)...) Show SMILES O=C(NC1(CCNCC1)C(=O)NCCc1c[nH]c2ccccc12)\C=C\c1ccc(OCc2ccccc2)cc1 Show InChI InChI=1S/C32H34N4O3/c37-30(15-12-24-10-13-27(14-11-24)39-23-25-6-2-1-3-7-25)36-32(17-20-33-21-18-32)31(38)34-19-16-26-22-35-29-9-5-4-8-28(26)29/h1-15,22,33,35H,16-21,23H2,(H,34,38)(H,36,37)/b15-12+	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Kuopio Curated by ChEMBL					Assay Description Inhibition of SIRT2				Bioorg Med Chem Lett 17: 2448-51 (2007) Article DOI: 10.1016/j.bmcl.2007.02.023 BindingDB Entry DOI: 10.7270/Q2CR5V53
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50199445 ((E)-N-(2-(5-fluoro-1H-indol-3-yl)ethyl)-4-(3-(4-(4...) Show SMILES Fc1ccc(COc2ccc(\C=C\C(=O)NC3(CCNCC3)C(=O)NCCc3c[nH]c4ccc(F)cc34)cc2)cc1 Show InChI InChI=1S/C32H32F2N4O3/c33-25-6-1-23(2-7-25)21-41-27-9-3-22(4-10-27)5-12-30(39)38-32(14-17-35-18-15-32)31(40)36-16-13-24-20-37-29-11-8-26(34)19-28(24)29/h1-12,19-20,35,37H,13-18,21H2,(H,36,40)(H,38,39)/b12-5+	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Kuopio Curated by ChEMBL					Assay Description Inhibition of SIRT1				Bioorg Med Chem Lett 17: 2448-51 (2007) Article DOI: 10.1016/j.bmcl.2007.02.023 BindingDB Entry DOI: 10.7270/Q2CR5V53
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50156759 (5-((2-(3,5-dichloro-2-hydroxybenzylideneamino)phen...) Show SMILES Cc1ncc(CSc2ccccc2\N=C\c2cc(Cl)cc(Cl)c2O)c(CO)c1O Show InChI InChI=1S/C21H18Cl2N2O3S/c1-12-20(27)16(10-26)14(9-24-12)11-29-19-5-3-2-4-18(19)25-8-13-6-15(22)7-17(23)21(13)28/h2-9,26-28H,10-11H2,1H3/b25-8+	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.43E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Kuopio Curated by ChEMBL					Assay Description Inhibition of human recombinant GST-tagged SIRT2 by histone deacetylase assay				J Med Chem 47: 6292-8 (2004) Article DOI: 10.1021/jm049933m BindingDB Entry DOI: 10.7270/Q2S1820Z
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50156759 (5-((2-(3,5-dichloro-2-hydroxybenzylideneamino)phen...) Show SMILES Cc1ncc(CSc2ccccc2\N=C\c2cc(Cl)cc(Cl)c2O)c(CO)c1O Show InChI InChI=1S/C21H18Cl2N2O3S/c1-12-20(27)16(10-26)14(9-24-12)11-29-19-5-3-2-4-18(19)25-8-13-6-15(22)7-17(23)21(13)28/h2-9,26-28H,10-11H2,1H3/b25-8+	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.43E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Kuopio Curated by ChEMBL					Assay Description Inhibition of SIRT2				J Med Chem 49: 7907-11 (2006) Article DOI: 10.1021/jm060566j BindingDB Entry DOI: 10.7270/Q2G73FHM
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50241187 ((E)-N-(1-(2-(5-fluoro-1H-indol-3-yl)ethylamino)-2-...) Show SMILES CC(C)(NC(=O)\C=C\c1ccc(O)cc1)C(=O)NCCc1c[nH]c2ccc(F)cc12 Show InChI InChI=1S/C23H24FN3O3/c1-23(2,27-21(29)10-5-15-3-7-18(28)8-4-15)22(30)25-12-11-16-14-26-20-9-6-17(24)13-19(16)20/h3-10,13-14,26,28H,11-12H2,1-2H3,(H,25,30)(H,27,29)/b10-5+	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Kuopio Curated by ChEMBL					Assay Description Inhibition of SIRT2				Bioorg Med Chem Lett 17: 2448-51 (2007) Article DOI: 10.1016/j.bmcl.2007.02.023 BindingDB Entry DOI: 10.7270/Q2CR5V53
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50199448 (CD-03241 | CHEMBL386248) Show SMILES OCc1cccc(\C=N\c2cc(cc(c2)C(F)(F)F)\N=C\c2cccc(CO)c2O)c1O Show InChI InChI=1S/C23H19F3N2O4/c24-23(25,26)18-7-19(27-10-14-3-1-5-16(12-29)21(14)31)9-20(8-18)28-11-15-4-2-6-17(13-30)22(15)32/h1-11,29-32H,12-13H2/b27-10+,28-11+	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	9.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Kuopio Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT2				J Med Chem 49: 7239-41 (2006) Article DOI: 10.1021/jm060686r BindingDB Entry DOI: 10.7270/Q2WM1D24
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50241184 ((E)-N-(1-(2-(1H-indol-3-yl)ethylamino)-2-methyl-1-...) Show SMILES COc1ccc(\C=C\C(=O)NC(C)(C)C(=O)NCCc2c[nH]c3ccccc23)cc1 Show InChI InChI=1S/C24H27N3O3/c1-24(2,27-22(28)13-10-17-8-11-19(30-3)12-9-17)23(29)25-15-14-18-16-26-21-7-5-4-6-20(18)21/h4-13,16,26H,14-15H2,1-3H3,(H,25,29)(H,27,28)/b13-10+	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.90E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Kuopio Curated by ChEMBL					Assay Description Inhibition of SIRT2				Bioorg Med Chem Lett 17: 2448-51 (2007) Article DOI: 10.1016/j.bmcl.2007.02.023 BindingDB Entry DOI: 10.7270/Q2CR5V53
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM27507 (3-Pyridinecarboxamide | CHEMBL1140 | NAM | niacina...) Show SMILES NC(=O)c1cccnc1 Show InChI InChI=1S/C6H6N2O/c7-6(9)5-2-1-3-8-4-5/h1-4H,(H2,7,9)	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	1.01E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Kuopio Curated by ChEMBL					Assay Description Inhibition of human recombinant GST-tagged SIRT2 by histone deacetylase assay				J Med Chem 47: 6292-8 (2004) Article DOI: 10.1021/jm049933m BindingDB Entry DOI: 10.7270/Q2S1820Z
					More data for this Ligand-Target Pair				3D Structure (crystal)
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50199446 (3-[(2-Cyano-ethyl)-(4-{4-[4-(5,5,8,8-tetramethyl-5...) Show SMILES CC1(C)CCC(C)(C)c2cc(ccc12)-c1csc(n1)C1CCN(Cc2ccc(cc2)N(CCC#N)CCC#N)CC1 Show InChI InChI=1S/C35H43N5S/c1-34(2)15-16-35(3,4)31-23-28(9-12-30(31)34)32-25-41-33(38-32)27-13-21-39(22-14-27)24-26-7-10-29(11-8-26)40(19-5-17-36)20-6-18-37/h7-12,23,25,27H,5-6,13-16,19-22,24H2,1-4H3	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.36E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Kuopio Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT2				J Med Chem 49: 7239-41 (2006) Article DOI: 10.1021/jm060686r BindingDB Entry DOI: 10.7270/Q2WM1D24
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50201114 (CHEMBL220354 | N,N'-bis(4-hydroxybenzylidene)napht...) Show SMILES Oc1ccc(\C=N\c2ccc(\N=C\c3ccc(O)cc3)c3ccccc23)cc1 Show InChI InChI=1S/C24H18N2O2/c27-19-9-5-17(6-10-19)15-25-23-13-14-24(22-4-2-1-3-21(22)23)26-16-18-7-11-20(28)12-8-18/h1-16,27-28H/b25-15+,26-16+	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.37E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Kuopio Curated by ChEMBL					Assay Description Inhibition of SIRT2				J Med Chem 49: 7907-11 (2006) Article DOI: 10.1021/jm060566j BindingDB Entry DOI: 10.7270/Q2G73FHM
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50201113 (CHEMBL220300 | N,N'-bis(3-hydroxybenzylidene)napht...) Show SMILES Oc1cccc(\C=N\c2ccc(\N=C\c3cccc(O)c3)c3ccccc23)c1 Show InChI InChI=1S/C24H18N2O2/c27-19-7-3-5-17(13-19)15-25-23-11-12-24(22-10-2-1-9-21(22)23)26-16-18-6-4-8-20(28)14-18/h1-16,27-28H/b25-15+,26-16+	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.96E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Kuopio Curated by ChEMBL					Assay Description Inhibition of SIRT2				J Med Chem 49: 7907-11 (2006) Article DOI: 10.1021/jm060566j BindingDB Entry DOI: 10.7270/Q2G73FHM
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50199447 (CHEMBL215284 | N-(3-(2-ethylhexyloxy)propyl)-4,4-b...) Show SMILES CCCCC(CC)COCCCNC(=O)CCC(C)(c1ccc(O)cc1)c1ccc(O)cc1 Show InChI InChI=1S/C28H41NO4/c1-4-6-8-22(5-2)21-33-20-7-19-29-27(32)17-18-28(3,23-9-13-25(30)14-10-23)24-11-15-26(31)16-12-24/h9-16,22,30-31H,4-8,17-21H2,1-3H3,(H,29,32)	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Kuopio Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT2				J Med Chem 49: 7239-41 (2006) Article DOI: 10.1021/jm060686r BindingDB Entry DOI: 10.7270/Q2WM1D24
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50156771 (4-(2-(4-(4-chlorophenyl)-5-mercapto-4H-1,2,4-triaz...) Show SMILES Oc1ccc(CCc2n[nH]c(=S)n2-c2ccc(Cl)cc2)cc1 Show InChI InChI=1S/C16H14ClN3OS/c17-12-4-6-13(7-5-12)20-15(18-19-16(20)22)10-3-11-1-8-14(21)9-2-11/h1-2,4-9,21H,3,10H2,(H,19,22)	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>3.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Kuopio Curated by ChEMBL					Assay Description Inhibition of human recombinant GST-tagged SIRT2 by histone deacetylase assay				J Med Chem 47: 6292-8 (2004) Article DOI: 10.1021/jm049933m BindingDB Entry DOI: 10.7270/Q2S1820Z
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50156767 (3-(3-(4-(phenoxymethyl)phenyl)ureido)benzoic acid ...) Show SMILES OC(=O)c1cccc(NC(=O)Nc2ccc(COc3ccccc3)cc2)c1 Show InChI InChI=1S/C21H18N2O4/c24-20(25)16-5-4-6-18(13-16)23-21(26)22-17-11-9-15(10-12-17)14-27-19-7-2-1-3-8-19/h1-13H,14H2,(H,24,25)(H2,22,23,26)	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>3.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Kuopio Curated by ChEMBL					Assay Description Inhibition of human recombinant GST-tagged SIRT2 by histone deacetylase assay				J Med Chem 47: 6292-8 (2004) Article DOI: 10.1021/jm049933m BindingDB Entry DOI: 10.7270/Q2S1820Z
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50156769 (4-((4-(2,3-dihydro-1H-inden-2-yl)-5-hydroxy-4H-1,2...) Show SMILES Oc1ccc2c(CSc3n[nH]c(=O)n3C3Cc4ccccc4C3)cc(=O)oc2c1 Show InChI InChI=1S/C21H17N3O4S/c25-16-5-6-17-14(9-19(26)28-18(17)10-16)11-29-21-23-22-20(27)24(21)15-7-12-3-1-2-4-13(12)8-15/h1-6,9-10,15,25H,7-8,11H2,(H,22,27)	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	>3.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Kuopio Curated by ChEMBL					Assay Description Inhibition of human recombinant GST-tagged SIRT2 by histone deacetylase assay				J Med Chem 47: 6292-8 (2004) Article DOI: 10.1021/jm049933m BindingDB Entry DOI: 10.7270/Q2S1820Z
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50156773 (2-(2-oxo-2-(4-(2-(trifluoromethyl)quinolin-4-yl)pi...) Show SMILES OC(=O)CSCC(=O)N1CCN(CC1)c1cc(nc2ccccc12)C(F)(F)F Show InChI InChI=1S/C18H18F3N3O3S/c19-18(20,21)15-9-14(12-3-1-2-4-13(12)22-15)23-5-7-24(8-6-23)16(25)10-28-11-17(26)27/h1-4,9H,5-8,10-11H2,(H,26,27)	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
University of Kuopio Curated by ChEMBL					Assay Description Inhibition of human recombinant GST-tagged SIRT2 by histone deacetylase assay				J Med Chem 47: 6292-8 (2004) Article DOI: 10.1021/jm049933m BindingDB Entry DOI: 10.7270/Q2S1820Z
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50156761 (6-(2-hydroxy-ethylsulfanyl)-2-(2-pyridin-2-yl-ethy...) Show SMILES OCCSc1ccc2C(=O)N(CCc3ccccn3)C(=O)c3cccc1c23 Show InChI InChI=1S/C21H18N2O3S/c24-12-13-27-18-8-7-17-19-15(18)5-3-6-16(19)20(25)23(21(17)26)11-9-14-4-1-2-10-22-14/h1-8,10,24H,9,11-13H2	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
University of Kuopio Curated by ChEMBL					Assay Description Inhibition of human recombinant GST-tagged SIRT2 by histone deacetylase assay				J Med Chem 47: 6292-8 (2004) Article DOI: 10.1021/jm049933m BindingDB Entry DOI: 10.7270/Q2S1820Z
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50156762 (2-(4-((2-(tert-butoxycarbonyl)-3-phenylpropanoylox...) Show SMILES CC(C)(C)OC(=O)NC(Cc1ccccc1)C(=O)OCc1ccc(CC(O)=O)cc1 Show InChI InChI=1S/C23H27NO6/c1-23(2,3)30-22(28)24-19(13-16-7-5-4-6-8-16)21(27)29-15-18-11-9-17(10-12-18)14-20(25)26/h4-12,19H,13-15H2,1-3H3,(H,24,28)(H,25,26)	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
University of Kuopio Curated by ChEMBL					Assay Description Inhibition of human recombinant GST-tagged SIRT2 by histone deacetylase assay				J Med Chem 47: 6292-8 (2004) Article DOI: 10.1021/jm049933m BindingDB Entry DOI: 10.7270/Q2S1820Z
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50156764 (5-(9-oxo-9H-xanthen-2-yloxy)pentanoic acid | CHEMB...) Show SMILES OC(=O)CCCCOc1ccc2oc3ccccc3c(=O)c2c1 Show InChI InChI=1S/C18H16O5/c19-17(20)7-3-4-10-22-12-8-9-16-14(11-12)18(21)13-5-1-2-6-15(13)23-16/h1-2,5-6,8-9,11H,3-4,7,10H2,(H,19,20)	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
University of Kuopio Curated by ChEMBL					Assay Description Inhibition of human recombinant GST-tagged SIRT2 by histone deacetylase assay				J Med Chem 47: 6292-8 (2004) Article DOI: 10.1021/jm049933m BindingDB Entry DOI: 10.7270/Q2S1820Z
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50156765 (2-((4-(3-(4-(2-hydroxybenzylideneamino)phenoxy)pro...) Show SMILES Oc1ccccc1\C=N\c1ccc(OCCCOc2ccc(cc2)\N=C\c2ccccc2O)cc1 Show InChI InChI=1S/C29H26N2O4/c32-28-8-3-1-6-22(28)20-30-24-10-14-26(15-11-24)34-18-5-19-35-27-16-12-25(13-17-27)31-21-23-7-2-4-9-29(23)33/h1-4,6-17,20-21,32-33H,5,18-19H2/b30-20+,31-21+	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
University of Kuopio Curated by ChEMBL					Assay Description Inhibition of human recombinant GST-tagged SIRT2 by histone deacetylase assay				J Med Chem 47: 6292-8 (2004) Article DOI: 10.1021/jm049933m BindingDB Entry DOI: 10.7270/Q2S1820Z
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50156766 (4-((4-(4-(3,4-dihydroxybenzylideneamino)benzyl)phe...) Show SMILES Oc1ccc(\C=N\c2ccc(Cc3ccc(cc3)\N=C\c3ccc(O)c(O)c3)cc2)cc1O Show InChI InChI=1S/C27H22N2O4/c30-24-11-5-20(14-26(24)32)16-28-22-7-1-18(2-8-22)13-19-3-9-23(10-4-19)29-17-21-6-12-25(31)27(33)15-21/h1-12,14-17,30-33H,13H2/b28-16+,29-17+	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
University of Kuopio Curated by ChEMBL					Assay Description Inhibition of human recombinant GST-tagged SIRT2 by histone deacetylase assay				J Med Chem 47: 6292-8 (2004) Article DOI: 10.1021/jm049933m BindingDB Entry DOI: 10.7270/Q2S1820Z
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50156758 (CHEMBL225118 | bis(4-((2-hydroxyethyl)(methyl)amin...) Show SMILES CN(CCO)c1ccc(cc1)C(=O)c1ccc(cc1)N(C)CCO Show InChI InChI=1S/C19H24N2O3/c1-20(11-13-22)17-7-3-15(4-8-17)19(24)16-5-9-18(10-6-16)21(2)12-14-23/h3-10,22-23H,11-14H2,1-2H3	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
University of Kuopio Curated by ChEMBL					Assay Description Inhibition of human recombinant GST-tagged SIRT2 by histone deacetylase assay				J Med Chem 47: 6292-8 (2004) Article DOI: 10.1021/jm049933m BindingDB Entry DOI: 10.7270/Q2S1820Z
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50156770 (4-(3-(2-hydroxybenzamido)phenylamino)-4-oxobut-2-e...) Show SMILES OC(=O)\C=C\C(=O)Nc1cccc(NC(=O)c2ccccc2O)c1 Show InChI InChI=1S/C17H14N2O5/c20-14-7-2-1-6-13(14)17(24)19-12-5-3-4-11(10-12)18-15(21)8-9-16(22)23/h1-10,20H,(H,18,21)(H,19,24)(H,22,23)/b9-8+	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
University of Kuopio Curated by ChEMBL					Assay Description Inhibition of human recombinant GST-tagged SIRT2 by histone deacetylase assay				J Med Chem 47: 6292-8 (2004) Article DOI: 10.1021/jm049933m BindingDB Entry DOI: 10.7270/Q2S1820Z
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50156772 (5-(4-benzamido-2-methoxy-5-methylphenylamino)-5-ox...) Show SMILES COc1cc(NC(=O)c2ccccc2)c(C)cc1NC(=O)CC(CC(O)=O)c1ccccc1 Show InChI InChI=1S/C26H26N2O5/c1-17-13-22(23(33-2)16-21(17)28-26(32)19-11-7-4-8-12-19)27-24(29)14-20(15-25(30)31)18-9-5-3-6-10-18/h3-13,16,20H,14-15H2,1-2H3,(H,27,29)(H,28,32)(H,30,31)	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
University of Kuopio Curated by ChEMBL					Assay Description Inhibition of human recombinant GST-tagged SIRT2 by histone deacetylase assay				J Med Chem 47: 6292-8 (2004) Article DOI: 10.1021/jm049933m BindingDB Entry DOI: 10.7270/Q2S1820Z
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50156768 (2-((4-(4-(4-(2-hydroxybenzylideneamino)phenoxy)but...) Show SMILES Oc1ccccc1\C=N\c1ccc(OCCCCOc2ccc(cc2)\N=C\c2ccccc2O)cc1 Show InChI InChI=1S/C30H28N2O4/c33-29-9-3-1-7-23(29)21-31-25-11-15-27(16-12-25)35-19-5-6-20-36-28-17-13-26(14-18-28)32-22-24-8-2-4-10-30(24)34/h1-4,7-18,21-22,33-34H,5-6,19-20H2/b31-21+,32-22+	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
University of Kuopio Curated by ChEMBL					Assay Description Inhibition of human recombinant GST-tagged SIRT2 by histone deacetylase assay				J Med Chem 47: 6292-8 (2004) Article DOI: 10.1021/jm049933m BindingDB Entry DOI: 10.7270/Q2S1820Z
					More data for this Ligand-Target Pair