Compile Data Set for Download or QSAR

Found 48 hits with Last Name = 'de maria' and Initial = 'r'   

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	160	n/a	n/a	n/a	n/a	n/a	n/a
Sapienza Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT1 expressed in Escherichia coli cells using acetylated Lys side chain amino acids 379-382 (Arg-His-Lys-Lys(Ac)) p...				J Med Chem 55: 8193-7 (2012) Article DOI: 10.1021/jm301115r BindingDB Entry DOI: 10.7270/Q2JW8G0C
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50216689 (2-cyano-3-(5-(2,5-dichlorophenyl)furan-2-yl)-N-(qu...) Show SMILES Clc1ccc(Cl)c(c1)-c1ccc(\C=C(/C#N)C(=O)Nc2cccc3ncccc23)o1 Show InChI InChI=1S/C23H13Cl2N3O2/c24-15-6-8-19(25)18(12-15)22-9-7-16(30-22)11-14(13-26)23(29)28-21-5-1-4-20-17(21)3-2-10-27-20/h1-12H,(H,28,29)/b14-11+	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	5.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sapienza Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT2 expressed in Escherichia coli cells using acetylated Lys side chain amino acids 379-382 (Arg-His-Lys-Lys(Ac)) p...				J Med Chem 55: 8193-7 (2012) Article DOI: 10.1021/jm301115r BindingDB Entry DOI: 10.7270/Q2JW8G0C
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50397035 (CHEMBL2171194) Show SMILES C=CCn1c(=O)nc2oc3ccc4ccccc4c3cc2c1=O Show InChI InChI=1S/C18H12N2O3/c1-2-9-20-17(21)14-10-13-12-6-4-3-5-11(12)7-8-15(13)23-16(14)19-18(20)22/h2-8,10H,1,9H2	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	6.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sapienza Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT1 expressed in Escherichia coli cells using acetylated Lys side chain amino acids 379-382 (Arg-His-Lys-Lys(Ac)) p...				J Med Chem 55: 8193-7 (2012) Article DOI: 10.1021/jm301115r BindingDB Entry DOI: 10.7270/Q2JW8G0C
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50397038 (CHEMBL2171191) Show SMILES Cn1c(=O)nc2oc3ccc4ccccc4c3cc2c1=O Show InChI InChI=1S/C16H10N2O3/c1-18-15(19)12-8-11-10-5-3-2-4-9(10)6-7-13(11)21-14(12)17-16(18)20/h2-8H,1H3	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	7.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sapienza Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT1 expressed in Escherichia coli cells using acetylated Lys side chain amino acids 379-382 (Arg-His-Lys-Lys(Ac)) p...				J Med Chem 55: 8193-7 (2012) Article DOI: 10.1021/jm301115r BindingDB Entry DOI: 10.7270/Q2JW8G0C
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50309831 (10-Phenyl-7-oxa-8,10-diaza-benzo[a]anthracene-9,11...) Show SMILES O=c1nc2oc3ccc4ccccc4c3cc2c(=O)n1-c1ccccc1 Show InChI InChI=1S/C21H12N2O3/c24-20-17-12-16-15-9-5-4-6-13(15)10-11-18(16)26-19(17)22-21(25)23(20)14-7-2-1-3-8-14/h1-12H	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	8.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sapienza Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT1 expressed in Escherichia coli using Fluor de Lys substrate by fluorescence assay				J Med Chem 55: 8193-7 (2012) Article DOI: 10.1021/jm301115r BindingDB Entry DOI: 10.7270/Q2JW8G0C
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50397036 (CHEMBL2171193) Show SMILES CCCn1c(=O)nc2oc3ccc4ccccc4c3cc2c1=O Show InChI InChI=1S/C18H14N2O3/c1-2-9-20-17(21)14-10-13-12-6-4-3-5-11(12)7-8-15(13)23-16(14)19-18(20)22/h3-8,10H,2,9H2,1H3	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	9.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sapienza Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT1 expressed in Escherichia coli cells using acetylated Lys side chain amino acids 379-382 (Arg-His-Lys-Lys(Ac)) p...				J Med Chem 55: 8193-7 (2012) Article DOI: 10.1021/jm301115r BindingDB Entry DOI: 10.7270/Q2JW8G0C
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50309831 (10-Phenyl-7-oxa-8,10-diaza-benzo[a]anthracene-9,11...) Show SMILES O=c1nc2oc3ccc4ccccc4c3cc2c(=O)n1-c1ccccc1 Show InChI InChI=1S/C21H12N2O3/c24-20-17-12-16-15-9-5-4-6-13(15)10-11-18(16)26-19(17)22-21(25)23(20)14-7-2-1-3-8-14/h1-12H	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	9.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sapienza Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT1 expressed in Escherichia coli cells using acetylated Lys side chain amino acids 379-382 (Arg-His-Lys-Lys(Ac)) p...				J Med Chem 55: 8193-7 (2012) Article DOI: 10.1021/jm301115r BindingDB Entry DOI: 10.7270/Q2JW8G0C
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50397034 (CHEMBL2171195) Show SMILES CCCCn1c(=O)nc2oc3ccc4ccccc4c3cc2c1=O Show InChI InChI=1S/C19H16N2O3/c1-2-3-10-21-18(22)15-11-14-13-7-5-4-6-12(13)8-9-16(14)24-17(15)20-19(21)23/h4-9,11H,2-3,10H2,1H3	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	1.04E+4	n/a	n/a	n/a	n/a	n/a	n/a
Sapienza Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT1 expressed in Escherichia coli cells using acetylated Lys side chain amino acids 379-382 (Arg-His-Lys-Lys(Ac)) p...				J Med Chem 55: 8193-7 (2012) Article DOI: 10.1021/jm301115r BindingDB Entry DOI: 10.7270/Q2JW8G0C
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50397042 (CHEMBL2171198) Show SMILES Cn1c(=O)nc2oc3ccccc3cc2c1=O Show InChI InChI=1S/C12H8N2O3/c1-14-11(15)8-6-7-4-2-3-5-9(7)17-10(8)13-12(14)16/h2-6H,1H3	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	1.05E+4	n/a	n/a	n/a	n/a	n/a	n/a
Sapienza Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT1 expressed in Escherichia coli cells using acetylated Lys side chain amino acids 379-382 (Arg-His-Lys-Lys(Ac)) p...				J Med Chem 55: 8193-7 (2012) Article DOI: 10.1021/jm301115r BindingDB Entry DOI: 10.7270/Q2JW8G0C
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50397035 (CHEMBL2171194) Show SMILES C=CCn1c(=O)nc2oc3ccc4ccccc4c3cc2c1=O Show InChI InChI=1S/C18H12N2O3/c1-2-9-20-17(21)14-10-13-12-6-4-3-5-11(12)7-8-15(13)23-16(14)19-18(20)22/h2-8,10H,1,9H2	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	1.08E+4	n/a	n/a	n/a	n/a	n/a	n/a
Sapienza Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT2 expressed in Escherichia coli cells using acetylated Lys side chain amino acids 379-382 (Arg-His-Lys-Lys(Ac)) p...				J Med Chem 55: 8193-7 (2012) Article DOI: 10.1021/jm301115r BindingDB Entry DOI: 10.7270/Q2JW8G0C
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50397038 (CHEMBL2171191) Show SMILES Cn1c(=O)nc2oc3ccc4ccccc4c3cc2c1=O Show InChI InChI=1S/C16H10N2O3/c1-18-15(19)12-8-11-10-5-3-2-4-9(10)6-7-13(11)21-14(12)17-16(18)20/h2-8H,1H3	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	1.12E+4	n/a	n/a	n/a	n/a	n/a	n/a
Sapienza Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT2 expressed in Escherichia coli cells using acetylated Lys side chain amino acids 379-382 (Arg-His-Lys-Lys(Ac)) p...				J Med Chem 55: 8193-7 (2012) Article DOI: 10.1021/jm301115r BindingDB Entry DOI: 10.7270/Q2JW8G0C
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50397041 (CHEMBL2171199) Show SMILES CCn1c(=O)nc2oc3ccccc3cc2c1=O Show InChI InChI=1S/C13H10N2O3/c1-2-15-12(16)9-7-8-5-3-4-6-10(8)18-11(9)14-13(15)17/h3-7H,2H2,1H3	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	1.18E+4	n/a	n/a	n/a	n/a	n/a	n/a
Sapienza Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT1 expressed in Escherichia coli cells using acetylated Lys side chain amino acids 379-382 (Arg-His-Lys-Lys(Ac)) p...				J Med Chem 55: 8193-7 (2012) Article DOI: 10.1021/jm301115r BindingDB Entry DOI: 10.7270/Q2JW8G0C
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50397032 (CHEMBL2171197) Show SMILES O=c1nc2oc3ccc4ccccc4c3cc2c(=O)n1Cc1ccccc1 Show InChI InChI=1S/C22H14N2O3/c25-21-18-12-17-16-9-5-4-8-15(16)10-11-19(17)27-20(18)23-22(26)24(21)13-14-6-2-1-3-7-14/h1-12H,13H2	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	1.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
Sapienza Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT1 expressed in Escherichia coli cells using acetylated Lys side chain amino acids 379-382 (Arg-His-Lys-Lys(Ac)) p...				J Med Chem 55: 8193-7 (2012) Article DOI: 10.1021/jm301115r BindingDB Entry DOI: 10.7270/Q2JW8G0C
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50309831 (10-Phenyl-7-oxa-8,10-diaza-benzo[a]anthracene-9,11...) Show SMILES O=c1nc2oc3ccc4ccccc4c3cc2c(=O)n1-c1ccccc1 Show InChI InChI=1S/C21H12N2O3/c24-20-17-12-16-15-9-5-4-6-13(15)10-11-18(16)26-19(17)22-21(25)23(20)14-7-2-1-3-8-14/h1-12H	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.23E+4	n/a	n/a	n/a	n/a	n/a	n/a
Sapienza Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT2 expressed in Escherichia coli cells using acetylated Lys side chain amino acids 379-382 (Arg-His-Lys-Lys(Ac)) p...				J Med Chem 55: 8193-7 (2012) Article DOI: 10.1021/jm301115r BindingDB Entry DOI: 10.7270/Q2JW8G0C
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50397040 (CHEMBL2171200) Show SMILES CCCn1c(=O)nc2oc3ccccc3cc2c1=O Show InChI InChI=1S/C14H12N2O3/c1-2-7-16-13(17)10-8-9-5-3-4-6-11(9)19-12(10)15-14(16)18/h3-6,8H,2,7H2,1H3	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	1.25E+4	n/a	n/a	n/a	n/a	n/a	n/a
Sapienza Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT1 expressed in Escherichia coli cells using acetylated Lys side chain amino acids 379-382 (Arg-His-Lys-Lys(Ac)) p...				J Med Chem 55: 8193-7 (2012) Article DOI: 10.1021/jm301115r BindingDB Entry DOI: 10.7270/Q2JW8G0C
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50397036 (CHEMBL2171193) Show SMILES CCCn1c(=O)nc2oc3ccc4ccccc4c3cc2c1=O Show InChI InChI=1S/C18H14N2O3/c1-2-9-20-17(21)14-10-13-12-6-4-3-5-11(12)7-8-15(13)23-16(14)19-18(20)22/h3-8,10H,2,9H2,1H3	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	1.25E+4	n/a	n/a	n/a	n/a	n/a	n/a
Sapienza Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT2 expressed in Escherichia coli cells using acetylated Lys side chain amino acids 379-382 (Arg-His-Lys-Lys(Ac)) p...				J Med Chem 55: 8193-7 (2012) Article DOI: 10.1021/jm301115r BindingDB Entry DOI: 10.7270/Q2JW8G0C
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50397039 (CHEMBL2171201) Show SMILES CCCCn1c(=O)nc2oc3ccccc3cc2c1=O Show InChI InChI=1S/C15H14N2O3/c1-2-3-8-17-14(18)11-9-10-6-4-5-7-12(10)20-13(11)16-15(17)19/h4-7,9H,2-3,8H2,1H3	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	1.41E+4	n/a	n/a	n/a	n/a	n/a	n/a
Sapienza Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT1 expressed in Escherichia coli cells using acetylated Lys side chain amino acids 379-382 (Arg-His-Lys-Lys(Ac)) p...				J Med Chem 55: 8193-7 (2012) Article DOI: 10.1021/jm301115r BindingDB Entry DOI: 10.7270/Q2JW8G0C
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50397032 (CHEMBL2171197) Show SMILES O=c1nc2oc3ccc4ccccc4c3cc2c(=O)n1Cc1ccccc1 Show InChI InChI=1S/C22H14N2O3/c25-21-18-12-17-16-9-5-4-8-15(16)10-11-19(17)27-20(18)23-22(26)24(21)13-14-6-2-1-3-7-14/h1-12H,13H2	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	1.59E+4	n/a	n/a	n/a	n/a	n/a	n/a
Sapienza Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT2 expressed in Escherichia coli cells using acetylated Lys side chain amino acids 379-382 (Arg-His-Lys-Lys(Ac)) p...				J Med Chem 55: 8193-7 (2012) Article DOI: 10.1021/jm301115r BindingDB Entry DOI: 10.7270/Q2JW8G0C
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50397034 (CHEMBL2171195) Show SMILES CCCCn1c(=O)nc2oc3ccc4ccccc4c3cc2c1=O Show InChI InChI=1S/C19H16N2O3/c1-2-3-10-21-18(22)15-11-14-13-7-5-4-6-12(13)8-9-16(14)24-17(15)20-19(21)23/h4-9,11H,2-3,10H2,1H3	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	1.69E+4	n/a	n/a	n/a	n/a	n/a	n/a
Sapienza Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT2 expressed in Escherichia coli cells using acetylated Lys side chain amino acids 379-382 (Arg-His-Lys-Lys(Ac)) p...				J Med Chem 55: 8193-7 (2012) Article DOI: 10.1021/jm301115r BindingDB Entry DOI: 10.7270/Q2JW8G0C
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50309829 (1-((3-(2-phenylpropylthio)phenylimino)methyl)napht...) Show SMILES CC(CSc1cccc(c1)\N=C\c1c(O)ccc2ccccc12)c1ccccc1 Show InChI InChI=1S/C26H23NOS/c1-19(20-8-3-2-4-9-20)18-29-23-12-7-11-22(16-23)27-17-25-24-13-6-5-10-21(24)14-15-26(25)28/h2-17,19,28H,18H2,1H3/b27-17+	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	1.92E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of human SIRT2 expressed in Escherichia coli using Gln-Pro-Lys-Lys(Ac) as substrate after 1 hr by Fluor de Lys fluorescence based assay				J Med Chem 55: 10937-47 (2012) Article DOI: 10.1021/jm3011614 BindingDB Entry DOI: 10.7270/Q28G8MVM
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50397037 (CHEMBL2171192) Show SMILES CCn1c(=O)nc2oc3ccc4ccccc4c3cc2c1=O Show InChI InChI=1S/C17H12N2O3/c1-2-19-16(20)13-9-12-11-6-4-3-5-10(11)7-8-14(12)22-15(13)18-17(19)21/h3-9H,2H2,1H3	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	2.02E+4	n/a	n/a	n/a	n/a	n/a	n/a
Sapienza Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT1 expressed in Escherichia coli cells using acetylated Lys side chain amino acids 379-382 (Arg-His-Lys-Lys(Ac)) p...				J Med Chem 55: 8193-7 (2012) Article DOI: 10.1021/jm301115r BindingDB Entry DOI: 10.7270/Q2JW8G0C
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50397033 (CHEMBL2171196) Show SMILES O=c1nc2oc3ccc4ccccc4c3cc2c(=O)n1C1CCCCC1 Show InChI InChI=1S/C21H18N2O3/c24-20-17-12-16-15-9-5-4-6-13(15)10-11-18(16)26-19(17)22-21(25)23(20)14-7-2-1-3-8-14/h4-6,9-12,14H,1-3,7-8H2	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	2.11E+4	n/a	n/a	n/a	n/a	n/a	n/a
Sapienza Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT1 expressed in Escherichia coli cells using acetylated Lys side chain amino acids 379-382 (Arg-His-Lys-Lys(Ac)) p...				J Med Chem 55: 8193-7 (2012) Article DOI: 10.1021/jm301115r BindingDB Entry DOI: 10.7270/Q2JW8G0C
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50397041 (CHEMBL2171199) Show SMILES CCn1c(=O)nc2oc3ccccc3cc2c1=O Show InChI InChI=1S/C13H10N2O3/c1-2-15-12(16)9-7-8-5-3-4-6-10(8)18-11(9)14-13(15)17/h3-7H,2H2,1H3	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	2.25E+4	n/a	n/a	n/a	n/a	n/a	n/a
Sapienza Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT2 expressed in Escherichia coli cells using acetylated Lys side chain amino acids 379-382 (Arg-His-Lys-Lys(Ac)) p...				J Med Chem 55: 8193-7 (2012) Article DOI: 10.1021/jm301115r BindingDB Entry DOI: 10.7270/Q2JW8G0C
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50309828 ((E)-4-((2-hydroxynaphthalen-1-yl)methyleneamino)-N...) Show SMILES CC(NS(=O)(=O)c1ccc(cc1)\N=C\c1c(O)ccc2ccccc12)c1ccccc1 Show InChI InChI=1S/C25H22N2O3S/c1-18(19-7-3-2-4-8-19)27-31(29,30)22-14-12-21(13-15-22)26-17-24-23-10-6-5-9-20(23)11-16-25(24)28/h2-18,27-28H,1H3/b26-17+	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	2.26E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of human SIRT2 expressed in Escherichia coli using Gln-Pro-Lys-Lys(Ac) as substrate after 1 hr by Fluor de Lys fluorescence based assay				J Med Chem 55: 10937-47 (2012) Article DOI: 10.1021/jm3011614 BindingDB Entry DOI: 10.7270/Q28G8MVM
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50400320 (CHEMBL2181509) Show SMILES CC(CS(=O)(=O)c1ccccc1\N=C\c1c(O)ccc2ccccc12)c1ccccc1 Show InChI InChI=1S/C26H23NO3S/c1-19(20-9-3-2-4-10-20)18-31(29,30)26-14-8-7-13-24(26)27-17-23-22-12-6-5-11-21(22)15-16-25(23)28/h2-17,19,28H,18H2,1H3/b27-17+	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	2.42E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of human SIRT2 expressed in Escherichia coli using Gln-Pro-Lys-Lys(Ac) as substrate after 1 hr by Fluor de Lys fluorescence based assay				J Med Chem 55: 10937-47 (2012) Article DOI: 10.1021/jm3011614 BindingDB Entry DOI: 10.7270/Q28G8MVM
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50397042 (CHEMBL2171198) Show SMILES Cn1c(=O)nc2oc3ccccc3cc2c1=O Show InChI InChI=1S/C12H8N2O3/c1-14-11(15)8-6-7-4-2-3-5-9(7)17-10(8)13-12(14)16/h2-6H,1H3	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	2.46E+4	n/a	n/a	n/a	n/a	n/a	n/a
Sapienza Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT2 expressed in Escherichia coli cells using acetylated Lys side chain amino acids 379-382 (Arg-His-Lys-Lys(Ac)) p...				J Med Chem 55: 8193-7 (2012) Article DOI: 10.1021/jm301115r BindingDB Entry DOI: 10.7270/Q2JW8G0C
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50309827 (CHEMBL597845 | Salermide) Show SMILES CC(C(=O)Nc1cccc(c1)\N=C\c1c(O)ccc2ccccc12)c1ccccc1 Show InChI InChI=1S/C26H22N2O2/c1-18(19-8-3-2-4-9-19)26(30)28-22-12-7-11-21(16-22)27-17-24-23-13-6-5-10-20(23)14-15-25(24)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 Similars	Article PubMed	n/a	n/a	2.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of human SIRT2 expressed in Escherichia coli using Gln-Pro-Lys-Lys(Ac) as substrate after 1 hr by Fluor de Lys fluorescence based assay				J Med Chem 55: 10937-47 (2012) Article DOI: 10.1021/jm3011614 BindingDB Entry DOI: 10.7270/Q28G8MVM
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50397040 (CHEMBL2171200) Show SMILES CCCn1c(=O)nc2oc3ccccc3cc2c1=O Show InChI InChI=1S/C14H12N2O3/c1-2-7-16-13(17)10-8-9-5-3-4-6-11(9)19-12(10)15-14(16)18/h3-6,8H,2,7H2,1H3	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	2.99E+4	n/a	n/a	n/a	n/a	n/a	n/a
Sapienza Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT2 expressed in Escherichia coli cells using acetylated Lys side chain amino acids 379-382 (Arg-His-Lys-Lys(Ac)) p...				J Med Chem 55: 8193-7 (2012) Article DOI: 10.1021/jm301115r BindingDB Entry DOI: 10.7270/Q2JW8G0C
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50397037 (CHEMBL2171192) Show SMILES CCn1c(=O)nc2oc3ccc4ccccc4c3cc2c1=O Show InChI InChI=1S/C17H12N2O3/c1-2-19-16(20)13-9-12-11-6-4-3-5-10(11)7-8-14(12)22-15(13)18-17(19)21/h3-9H,2H2,1H3	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+4	n/a	n/a	n/a	n/a	n/a	n/a
Sapienza Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT2 expressed in Escherichia coli cells using acetylated Lys side chain amino acids 379-382 (Arg-His-Lys-Lys(Ac)) p...				J Med Chem 55: 8193-7 (2012) Article DOI: 10.1021/jm301115r BindingDB Entry DOI: 10.7270/Q2JW8G0C
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50397039 (CHEMBL2171201) Show SMILES CCCCn1c(=O)nc2oc3ccccc3cc2c1=O Show InChI InChI=1S/C15H14N2O3/c1-2-3-8-17-14(18)11-9-10-6-4-5-7-12(10)20-13(11)16-15(17)19/h4-7,9H,2-3,8H2,1H3	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	3.08E+4	n/a	n/a	n/a	n/a	n/a	n/a
Sapienza Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT2 expressed in Escherichia coli cells using acetylated Lys side chain amino acids 379-382 (Arg-His-Lys-Lys(Ac)) p...				J Med Chem 55: 8193-7 (2012) Article DOI: 10.1021/jm301115r BindingDB Entry DOI: 10.7270/Q2JW8G0C
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50216689 (2-cyano-3-(5-(2,5-dichlorophenyl)furan-2-yl)-N-(qu...) Show SMILES Clc1ccc(Cl)c(c1)-c1ccc(\C=C(/C#N)C(=O)Nc2cccc3ncccc23)o1 Show InChI InChI=1S/C23H13Cl2N3O2/c24-15-6-8-19(25)18(12-15)22-9-7-16(30-22)11-14(13-26)23(29)28-21-5-1-4-20-17(21)3-2-10-27-20/h1-12H,(H,28,29)/b14-11+	PDB NCI pathway Reactome 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	3.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
Sapienza Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT1 expressed in Escherichia coli cells using acetylated Lys side chain amino acids 379-382 (Arg-His-Lys-Lys(Ac)) p...				J Med Chem 55: 8193-7 (2012) Article DOI: 10.1021/jm301115r BindingDB Entry DOI: 10.7270/Q2JW8G0C
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50400329 (CHEMBL2181512) Show SMILES CC(C(=O)Nc1ccccc1\N=C\c1c(O)ccc2ccccc12)c1ccccc1 Show InChI InChI=1S/C26H22N2O2/c1-18(19-9-3-2-4-10-19)26(30)28-24-14-8-7-13-23(24)27-17-22-21-12-6-5-11-20(21)15-16-25(22)29/h2-18,29H,1H3,(H,28,30)/b27-17+	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	4.03E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged SIRT1 expressed in Escherichia coli using Arg-His- Lys-Lys(Ac) as substrate after 1 hr by Fluor de Lys fluo...				J Med Chem 55: 10937-47 (2012) Article DOI: 10.1021/jm3011614 BindingDB Entry DOI: 10.7270/Q28G8MVM
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50400322 (CHEMBL2181515) Show SMILES CC(NS(=O)(=O)c1cccc(c1)\N=C\c1c(O)ccc2ccccc12)c1ccccc1 Show InChI InChI=1S/C25H22N2O3S/c1-18(19-8-3-2-4-9-19)27-31(29,30)22-12-7-11-21(16-22)26-17-24-23-13-6-5-10-20(23)14-15-25(24)28/h2-18,27-28H,1H3/b26-17+	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	4.03E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged SIRT1 expressed in Escherichia coli using Arg-His- Lys-Lys(Ac) as substrate after 1 hr by Fluor de Lys fluo...				J Med Chem 55: 10937-47 (2012) Article DOI: 10.1021/jm3011614 BindingDB Entry DOI: 10.7270/Q28G8MVM
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50400328 (CHEMBL2181510) Show SMILES CC(CS(=O)(=O)c1cccc(c1)\N=C\c1c(O)ccc2ccccc12)c1ccccc1 Show InChI InChI=1S/C26H23NO3S/c1-19(20-8-3-2-4-9-20)18-31(29,30)23-12-7-11-22(16-23)27-17-25-24-13-6-5-10-21(24)14-15-26(25)28/h2-17,19,28H,18H2,1H3/b27-17+	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	4.03E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged SIRT1 expressed in Escherichia coli using Arg-His- Lys-Lys(Ac) as substrate after 1 hr by Fluor de Lys fluo...				J Med Chem 55: 10937-47 (2012) Article DOI: 10.1021/jm3011614 BindingDB Entry DOI: 10.7270/Q28G8MVM
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50400320 (CHEMBL2181509) Show SMILES CC(CS(=O)(=O)c1ccccc1\N=C\c1c(O)ccc2ccccc12)c1ccccc1 Show InChI InChI=1S/C26H23NO3S/c1-19(20-9-3-2-4-10-20)18-31(29,30)26-14-8-7-13-24(26)27-17-23-22-12-6-5-11-21(22)15-16-25(23)28/h2-17,19,28H,18H2,1H3/b27-17+	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	4.03E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged SIRT1 expressed in Escherichia coli using Arg-His- Lys-Lys(Ac) as substrate after 1 hr by Fluor de Lys fluo...				J Med Chem 55: 10937-47 (2012) Article DOI: 10.1021/jm3011614 BindingDB Entry DOI: 10.7270/Q28G8MVM
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50400327 (CHEMBL2181508) Show SMILES CC(CS(=O)c1ccc(cc1)N=Cc1c(O)ccc2ccccc12)c1ccccc1 |w:11.11| Show InChI InChI=1S/C26H23NO2S/c1-19(20-7-3-2-4-8-20)18-30(29)23-14-12-22(13-15-23)27-17-25-24-10-6-5-9-21(24)11-16-26(25)28/h2-17,19,28H,18H2,1H3	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	4.03E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged SIRT1 expressed in Escherichia coli using Arg-His- Lys-Lys(Ac) as substrate after 1 hr by Fluor de Lys fluo...				J Med Chem 55: 10937-47 (2012) Article DOI: 10.1021/jm3011614 BindingDB Entry DOI: 10.7270/Q28G8MVM
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50400326 (CHEMBL2181507) Show SMILES CC(CS(=O)c1cccc(c1)N=Cc1c(O)ccc2ccccc12)c1ccccc1 |w:11.11| Show InChI InChI=1S/C26H23NO2S/c1-19(20-8-3-2-4-9-20)18-30(29)23-12-7-11-22(16-23)27-17-25-24-13-6-5-10-21(24)14-15-26(25)28/h2-17,19,28H,18H2,1H3	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	4.03E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged SIRT1 expressed in Escherichia coli using Arg-His- Lys-Lys(Ac) as substrate after 1 hr by Fluor de Lys fluo...				J Med Chem 55: 10937-47 (2012) Article DOI: 10.1021/jm3011614 BindingDB Entry DOI: 10.7270/Q28G8MVM
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50309827 (CHEMBL597845 | Salermide) Show SMILES CC(C(=O)Nc1cccc(c1)\N=C\c1c(O)ccc2ccccc12)c1ccccc1 Show InChI InChI=1S/C26H22N2O2/c1-18(19-8-3-2-4-9-19)26(30)28-22-12-7-11-21(16-22)27-17-24-23-13-6-5-10-20(23)14-15-25(24)29/h2-18,29H,1H3,(H,28,30)/b27-17+	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.03E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged SIRT1 expressed in Escherichia coli using Arg-His- Lys-Lys(Ac) as substrate after 1 hr by Fluor de Lys fluo...				J Med Chem 55: 10937-47 (2012) Article DOI: 10.1021/jm3011614 BindingDB Entry DOI: 10.7270/Q28G8MVM
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50309828 ((E)-4-((2-hydroxynaphthalen-1-yl)methyleneamino)-N...) Show SMILES CC(NS(=O)(=O)c1ccc(cc1)\N=C\c1c(O)ccc2ccccc12)c1ccccc1 Show InChI InChI=1S/C25H22N2O3S/c1-18(19-7-3-2-4-8-19)27-31(29,30)22-14-12-21(13-15-22)26-17-24-23-10-6-5-9-20(23)11-16-25(24)28/h2-18,27-28H,1H3/b26-17+	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	4.03E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged SIRT1 expressed in Escherichia coli using Arg-His- Lys-Lys(Ac) as substrate after 1 hr by Fluor de Lys fluo...				J Med Chem 55: 10937-47 (2012) Article DOI: 10.1021/jm3011614 BindingDB Entry DOI: 10.7270/Q28G8MVM
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50400323 (CHEMBL2181516) Show SMILES CC(CSc1ccccc1\N=C\c1c(O)ccc2ccccc12)c1ccccc1 Show InChI InChI=1S/C26H23NOS/c1-19(20-9-3-2-4-10-20)18-29-26-14-8-7-13-24(26)27-17-23-22-12-6-5-11-21(22)15-16-25(23)28/h2-17,19,28H,18H2,1H3/b27-17+	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	4.03E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged SIRT1 expressed in Escherichia coli using Arg-His- Lys-Lys(Ac) as substrate after 1 hr by Fluor de Lys fluo...				J Med Chem 55: 10937-47 (2012) Article DOI: 10.1021/jm3011614 BindingDB Entry DOI: 10.7270/Q28G8MVM
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50309829 (1-((3-(2-phenylpropylthio)phenylimino)methyl)napht...) Show SMILES CC(CSc1cccc(c1)\N=C\c1c(O)ccc2ccccc12)c1ccccc1 Show InChI InChI=1S/C26H23NOS/c1-19(20-8-3-2-4-9-20)18-29-23-12-7-11-22(16-23)27-17-25-24-13-6-5-10-21(24)14-15-26(25)28/h2-17,19,28H,18H2,1H3/b27-17+	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	4.03E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged SIRT1 expressed in Escherichia coli using Arg-His- Lys-Lys(Ac) as substrate after 1 hr by Fluor de Lys fluo...				J Med Chem 55: 10937-47 (2012) Article DOI: 10.1021/jm3011614 BindingDB Entry DOI: 10.7270/Q28G8MVM
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50400324 (CHEMBL2181517) Show SMILES CC(CSc1ccc(cc1)\N=C\c1c(O)ccc2ccccc12)c1ccccc1 Show InChI InChI=1S/C26H23NOS/c1-19(20-7-3-2-4-8-20)18-29-23-14-12-22(13-15-23)27-17-25-24-10-6-5-9-21(24)11-16-26(25)28/h2-17,19,28H,18H2,1H3/b27-17+	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	4.03E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged SIRT1 expressed in Escherichia coli using Arg-His- Lys-Lys(Ac) as substrate after 1 hr by Fluor de Lys fluo...				J Med Chem 55: 10937-47 (2012) Article DOI: 10.1021/jm3011614 BindingDB Entry DOI: 10.7270/Q28G8MVM
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50400325 (CHEMBL2181506) Show SMILES CC(CS(=O)c1ccccc1N=Cc1c(O)ccc2ccccc12)c1ccccc1 |w:11.11| Show InChI InChI=1S/C26H23NO2S/c1-19(20-9-3-2-4-10-20)18-30(29)26-14-8-7-13-24(26)27-17-23-22-12-6-5-11-21(22)15-16-25(23)28/h2-17,19,28H,18H2,1H3	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	4.03E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged SIRT1 expressed in Escherichia coli using Arg-His- Lys-Lys(Ac) as substrate after 1 hr by Fluor de Lys fluo...				J Med Chem 55: 10937-47 (2012) Article DOI: 10.1021/jm3011614 BindingDB Entry DOI: 10.7270/Q28G8MVM
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50400321 (CHEMBL2181513) Show SMILES CC(C(=O)Nc1ccc(cc1)\N=C\c1c(O)ccc2ccccc12)c1ccccc1 Show InChI InChI=1S/C26H22N2O2/c1-18(19-7-3-2-4-8-19)26(30)28-22-14-12-21(13-15-22)27-17-24-23-10-6-5-9-20(23)11-16-25(24)29/h2-18,29H,1H3,(H,28,30)/b27-17+	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	4.09E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma La Sapienza Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged SIRT1 expressed in Escherichia coli using Arg-His- Lys-Lys(Ac) as substrate after 1 hr by Fluor de Lys fluo...				J Med Chem 55: 10937-47 (2012) Article DOI: 10.1021/jm3011614 BindingDB Entry DOI: 10.7270/Q28G8MVM
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM29040 (cambinol) Show SMILES Oc1ccc2ccccc2c1Cc1c([nH]c(=S)[nH]c1=O)-c1ccccc1 Show InChI InChI=1S/C21H16N2O2S/c24-18-11-10-13-6-4-5-9-15(13)16(18)12-17-19(14-7-2-1-3-8-14)22-21(26)23-20(17)25/h1-11,24H,12H2,(H2,22,23,25,26)	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	4.21E+4	n/a	n/a	n/a	n/a	n/a	n/a
Sapienza Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT2 expressed in Escherichia coli cells using acetylated Lys side chain amino acids 379-382 (Arg-His-Lys-Lys(Ac)) p...				J Med Chem 55: 8193-7 (2012) Article DOI: 10.1021/jm301115r BindingDB Entry DOI: 10.7270/Q2JW8G0C
					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	4.85E+4	n/a	n/a	n/a	n/a	n/a	n/a
Sapienza Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT2 expressed in Escherichia coli cells using acetylated Lys side chain amino acids 379-382 (Arg-His-Lys-Lys(Ac)) p...				J Med Chem 55: 8193-7 (2012) Article DOI: 10.1021/jm301115r BindingDB Entry DOI: 10.7270/Q2JW8G0C
					More data for this Ligand-Target Pair				3D Structure (crystal)
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50397033 (CHEMBL2171196) Show SMILES O=c1nc2oc3ccc4ccccc4c3cc2c(=O)n1C1CCCCC1 Show InChI InChI=1S/C21H18N2O3/c24-20-17-12-16-15-9-5-4-6-13(15)10-11-18(16)26-19(17)22-21(25)23(20)14-7-2-1-3-8-14/h4-6,9-12,14H,1-3,7-8H2	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	5.85E+4	n/a	n/a	n/a	n/a	n/a	n/a
Sapienza Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT2 expressed in Escherichia coli cells using acetylated Lys side chain amino acids 379-382 (Arg-His-Lys-Lys(Ac)) p...				J Med Chem 55: 8193-7 (2012) Article DOI: 10.1021/jm301115r BindingDB Entry DOI: 10.7270/Q2JW8G0C
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50309831 (10-Phenyl-7-oxa-8,10-diaza-benzo[a]anthracene-9,11...) Show SMILES O=c1nc2oc3ccc4ccccc4c3cc2c(=O)n1-c1ccccc1 Show InChI InChI=1S/C21H12N2O3/c24-20-17-12-16-15-9-5-4-6-13(15)10-11-18(16)26-19(17)22-21(25)23(20)14-7-2-1-3-8-14/h1-12H	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.91E+5	n/a	n/a	n/a	n/a	n/a	n/a
Sapienza Universit£ di Roma Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT2 expressed in Escherichia coli using Fluor de Lys substrate by fluorescence assay				J Med Chem 55: 8193-7 (2012) Article DOI: 10.1021/jm301115r BindingDB Entry DOI: 10.7270/Q2JW8G0C
					More data for this Ligand-Target Pair