Compile Data Set for Download or QSAR

Found 94 hits with Last Name = 'shirazi' and Initial = 'an'   

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
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50142887 (1-(tert-butyl)-3-(4-chlorophenyl)-4-aminopyrazolo[...) Show SMILES CC(C)(C)n1nc(-c2ccc(Cl)cc2)c2c(N)ncnc12 Show InChI InChI=1S/C15H16ClN5/c1-15(2,3)21-14-11(13(17)18-8-19-14)12(20-21)9-4-6-10(16)7-5-9/h4-8H,1-3H3,(H2,17,18,19)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	500	n/a	n/a	n/a	n/a	n/a	n/a
Birla Institute of Technology and Science Curated by ChEMBL					Assay Description Inhibition of His6-tagged c-Src kinase domain using AEEEIYGEFEAKKKK as substrate pre-incubated for 10 mins before substrate addition measured after 3...				Bioorg Med Chem Lett 22: 410-4 (2011) Article DOI: 10.1016/j.bmcl.2011.10.124 BindingDB Entry DOI: 10.7270/Q23X872P
					More data for this Ligand-Target Pair
Tyrosine-protein kinase CSK (Homo sapiens (Human))	BDBM50142887 (1-(tert-butyl)-3-(4-chlorophenyl)-4-aminopyrazolo[...) Show SMILES CC(C)(C)n1nc(-c2ccc(Cl)cc2)c2c(N)ncnc12 Show InChI InChI=1S/C15H16ClN5/c1-15(2,3)21-14-11(13(17)18-8-19-14)12(20-21)9-4-6-10(16)7-5-9/h4-8H,1-3H3,(H2,17,18,19)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	500	n/a	n/a	n/a	n/a	7.5	25
University of Delhi, Delhi 110007, India					Assay Description The kinase reaction was initiated with the incubation of the 2.5 µL of the reaction cocktail (0.7 nM of His6-Src kinase domain in kinase buffer)...				Bioorg Chem 53: 75-82 (2014) Article DOI: 10.1016/j.bioorg.2014.02.001 BindingDB Entry DOI: 10.7270/Q2HX1BBK
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50059889 ((staurosporine)3-methoxy-2-methyl-4-methylamino-(2...) Show SMILES CN[C@@H]1CC2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 Show InChI InChI=1S/C28H26N4O3/c1-28-26(34-3)17(29-2)12-20(35-28)31-18-10-6-4-8-14(18)22-23-16(13-30-27(23)33)21-15-9-5-7-11-19(15)32(28)25(21)24(22)31/h4-11,17,20,26,29H,12-13H2,1-3H3,(H,30,33)/t17-,20?,26-,28+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	600	n/a	n/a	n/a	n/a	n/a	n/a
Birla Institute of Technology and Science Curated by ChEMBL					Assay Description Inhibition of His6-tagged c-Src kinase domain using AEEEIYGEFEAKKKK as substrate pre-incubated for 10 mins before substrate addition measured after 3...				Bioorg Med Chem Lett 22: 410-4 (2011) Article DOI: 10.1016/j.bmcl.2011.10.124 BindingDB Entry DOI: 10.7270/Q23X872P
					More data for this Ligand-Target Pair
Tyrosine-protein kinase CSK (Homo sapiens (Human))	BDBM2579 ((2S,3R,4R,6R)-3-methoxy-2-methyl-4-(methylamino)-2...) Show SMILES CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 |r| Show InChI InChI=1S/C28H26N4O3/c1-28-26(34-3)17(29-2)12-20(35-28)31-18-10-6-4-8-14(18)22-23-16(13-30-27(23)33)21-15-9-5-7-11-19(15)32(28)25(21)24(22)31/h4-11,17,20,26,29H,12-13H2,1-3H3,(H,30,33)/t17-,20-,26-,28+/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	600	n/a	n/a	n/a	n/a	7.5	25
University of Delhi, Delhi 110007, India					Assay Description The kinase reaction was initiated with the incubation of the 2.5 µL of the reaction cocktail (0.7 nM of His6-Src kinase domain in kinase buffer)...				Bioorg Chem 53: 75-82 (2014) Article DOI: 10.1016/j.bioorg.2014.02.001 BindingDB Entry DOI: 10.7270/Q2HX1BBK
					More data for this Ligand-Target Pair				3D Structure (crystal)
Tyrosine-protein kinase CSK (Homo sapiens (Human))	BDBM110206 (1-[2-(Dimethylamino)ethyl]-5-(2-hydroxy-4-methoxyb...) Show SMILES COc1ccc(C(=O)c2ccc(=O)n(CCN(C)C)c2)c(O)c1 Show InChI InChI=1S/C17H20N2O4/c1-18(2)8-9-19-11-12(4-7-16(19)21)17(22)14-6-5-13(23-3)10-15(14)20/h4-7,10-11,20H,8-9H2,1-3H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.25E+4	n/a	n/a	n/a	n/a	7.5	25
University of Delhi, Delhi 110007, India					Assay Description The kinase reaction was initiated with the incubation of the 2.5 µL of the reaction cocktail (0.7 nM of His6-Src kinase domain in kinase buffer)...				Bioorg Chem 53: 75-82 (2014) Article DOI: 10.1016/j.bioorg.2014.02.001 BindingDB Entry DOI: 10.7270/Q2HX1BBK
					More data for this Ligand-Target Pair
Tyrosine-protein kinase CSK (Homo sapiens (Human))	BDBM110208 (5-(2-Hydroxy-4-methoxybenzoyl)-1-(2-hydroxyethyl)p...) Show SMILES COc1ccc(C(=O)c2ccc(=O)n(CCO)c2)c(O)c1 Show InChI InChI=1S/C15H15NO5/c1-21-11-3-4-12(13(18)8-11)15(20)10-2-5-14(19)16(9-10)6-7-17/h2-5,8-9,17-18H,6-7H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.99E+4	n/a	n/a	n/a	n/a	7.5	25
University of Delhi, Delhi 110007, India					Assay Description The kinase reaction was initiated with the incubation of the 2.5 µL of the reaction cocktail (0.7 nM of His6-Src kinase domain in kinase buffer)...				Bioorg Chem 53: 75-82 (2014) Article DOI: 10.1016/j.bioorg.2014.02.001 BindingDB Entry DOI: 10.7270/Q2HX1BBK
					More data for this Ligand-Target Pair
Tyrosine-protein kinase CSK (Homo sapiens (Human))	BDBM110215 ((E)-1-Cyclohexyl-5-[(cyclohexylimino)(2-hydroxyphe...) Show SMILES Oc1ccccc1\C(=N\C1CCCCC1)c1ccc(=O)n(c1)C1CCCCC1 Show InChI InChI=1S/C24H30N2O2/c27-22-14-8-7-13-21(22)24(25-19-9-3-1-4-10-19)18-15-16-23(28)26(17-18)20-11-5-2-6-12-20/h7-8,13-17,19-20,27H,1-6,9-12H2/b25-24+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.01E+4	n/a	n/a	n/a	n/a	7.5	25
University of Delhi, Delhi 110007, India					Assay Description The kinase reaction was initiated with the incubation of the 2.5 µL of the reaction cocktail (0.7 nM of His6-Src kinase domain in kinase buffer)...				Bioorg Chem 53: 75-82 (2014) Article DOI: 10.1016/j.bioorg.2014.02.001 BindingDB Entry DOI: 10.7270/Q2HX1BBK
					More data for this Ligand-Target Pair
Tyrosine-protein kinase CSK (Homo sapiens (Human))	BDBM110199 (5-(2-Hydroxybenzoyl)-1-isopropylpyridin-2(1H)-one ...) Show SMILES CC(C)n1cc(ccc1=O)C(=O)c1ccccc1O Show InChI InChI=1S/C15H15NO3/c1-10(2)16-9-11(7-8-14(16)18)15(19)12-5-3-4-6-13(12)17/h3-10,17H,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.18E+4	n/a	n/a	n/a	n/a	7.5	25
University of Delhi, Delhi 110007, India					Assay Description The kinase reaction was initiated with the incubation of the 2.5 µL of the reaction cocktail (0.7 nM of His6-Src kinase domain in kinase buffer)...				Bioorg Chem 53: 75-82 (2014) Article DOI: 10.1016/j.bioorg.2014.02.001 BindingDB Entry DOI: 10.7270/Q2HX1BBK
					More data for this Ligand-Target Pair
Tyrosine-protein kinase CSK (Homo sapiens (Human))	BDBM110213 (t-Butyl [2-{5-(2-hydroxy-5-methoxybenzoyl)-2-oxopy...) Show SMILES COc1ccc(O)c(c1)C(=O)c1ccc(=O)n(CCNC(=O)OC(C)(C)C)c1 Show InChI InChI=1S/C20H24N2O6/c1-20(2,3)28-19(26)21-9-10-22-12-13(5-8-17(22)24)18(25)15-11-14(27-4)6-7-16(15)23/h5-8,11-12,23H,9-10H2,1-4H3,(H,21,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.19E+4	n/a	n/a	n/a	n/a	7.5	25
University of Delhi, Delhi 110007, India					Assay Description The kinase reaction was initiated with the incubation of the 2.5 µL of the reaction cocktail (0.7 nM of His6-Src kinase domain in kinase buffer)...				Bioorg Chem 53: 75-82 (2014) Article DOI: 10.1016/j.bioorg.2014.02.001 BindingDB Entry DOI: 10.7270/Q2HX1BBK
					More data for this Ligand-Target Pair
Tyrosine-protein kinase CSK (Homo sapiens (Human))	BDBM110209 (5-(2,5-Dihydroxybenzoyl)-1-hexylpyridin-2(1H)-one ...) Show SMILES CCCCCCn1cc(ccc1=O)C(=O)c1cc(O)ccc1O Show InChI InChI=1S/C18H21NO4/c1-2-3-4-5-10-19-12-13(6-9-17(19)22)18(23)15-11-14(20)7-8-16(15)21/h6-9,11-12,20-21H,2-5,10H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.21E+4	n/a	n/a	n/a	n/a	7.5	25
University of Delhi, Delhi 110007, India					Assay Description The kinase reaction was initiated with the incubation of the 2.5 µL of the reaction cocktail (0.7 nM of His6-Src kinase domain in kinase buffer)...				Bioorg Chem 53: 75-82 (2014) Article DOI: 10.1016/j.bioorg.2014.02.001 BindingDB Entry DOI: 10.7270/Q2HX1BBK
					More data for this Ligand-Target Pair
Tyrosine-protein kinase CSK (Homo sapiens (Human))	BDBM110211 (1-Hexyl-5-(2-hydroxy-5-methoxybenzoyl)pyridin-2(1H...) Show SMILES CCCCCCn1cc(ccc1=O)C(=O)c1cc(OC)ccc1O Show InChI InChI=1S/C19H23NO4/c1-3-4-5-6-11-20-13-14(7-10-18(20)22)19(23)16-12-15(24-2)8-9-17(16)21/h7-10,12-13,21H,3-6,11H2,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.35E+4	n/a	n/a	n/a	n/a	7.5	25
University of Delhi, Delhi 110007, India					Assay Description The kinase reaction was initiated with the incubation of the 2.5 µL of the reaction cocktail (0.7 nM of His6-Src kinase domain in kinase buffer)...				Bioorg Chem 53: 75-82 (2014) Article DOI: 10.1016/j.bioorg.2014.02.001 BindingDB Entry DOI: 10.7270/Q2HX1BBK
					More data for this Ligand-Target Pair
Tyrosine-protein kinase CSK (Homo sapiens (Human))	BDBM110212 (1-Cyclohexyl-5-(2-hydroxy-5-methoxybenzoyl)pyridin...) Show SMILES COc1ccc(O)c(c1)C(=O)c1ccc(=O)n(c1)C1CCCCC1 Show InChI InChI=1S/C19H21NO4/c1-24-15-8-9-17(21)16(11-15)19(23)13-7-10-18(22)20(12-13)14-5-3-2-4-6-14/h7-12,14,21H,2-6H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.48E+4	n/a	n/a	n/a	n/a	7.5	25
University of Delhi, Delhi 110007, India					Assay Description The kinase reaction was initiated with the incubation of the 2.5 µL of the reaction cocktail (0.7 nM of His6-Src kinase domain in kinase buffer)...				Bioorg Chem 53: 75-82 (2014) Article DOI: 10.1016/j.bioorg.2014.02.001 BindingDB Entry DOI: 10.7270/Q2HX1BBK
					More data for this Ligand-Target Pair
Tyrosine-protein kinase CSK (Homo sapiens (Human))	BDBM110200 (1-Cyclohexyl-5-(2-hydroxybenzoyl)pyridin-2(1H)-one...) Show SMILES Oc1ccccc1C(=O)c1ccc(=O)n(c1)C1CCCCC1 Show InChI InChI=1S/C18H19NO3/c20-16-9-5-4-8-15(16)18(22)13-10-11-17(21)19(12-13)14-6-2-1-3-7-14/h4-5,8-12,14,20H,1-3,6-7H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.54E+4	n/a	n/a	n/a	n/a	7.5	25
University of Delhi, Delhi 110007, India					Assay Description The kinase reaction was initiated with the incubation of the 2.5 µL of the reaction cocktail (0.7 nM of His6-Src kinase domain in kinase buffer)...				Bioorg Chem 53: 75-82 (2014) Article DOI: 10.1016/j.bioorg.2014.02.001 BindingDB Entry DOI: 10.7270/Q2HX1BBK
					More data for this Ligand-Target Pair
Tyrosine-protein kinase CSK (Homo sapiens (Human))	BDBM110210 (5-(2,5-Dihydroxybenzoyl)-1-isopropylpyridin-2(1H)-...) Show SMILES CC(C)n1cc(ccc1=O)C(=O)c1cc(O)ccc1O Show InChI InChI=1S/C15H15NO4/c1-9(2)16-8-10(3-6-14(16)19)15(20)12-7-11(17)4-5-13(12)18/h3-9,17-18H,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.61E+4	n/a	n/a	n/a	n/a	7.5	25
University of Delhi, Delhi 110007, India					Assay Description The kinase reaction was initiated with the incubation of the 2.5 µL of the reaction cocktail (0.7 nM of His6-Src kinase domain in kinase buffer)...				Bioorg Chem 53: 75-82 (2014) Article DOI: 10.1016/j.bioorg.2014.02.001 BindingDB Entry DOI: 10.7270/Q2HX1BBK
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50021513 (CHEMBL3290218) Show SMILES CCOC(=O)c1ccc2n(c(nc2c1)-c1ccc(cc1)N(C)C)-c1ccccc1 Show InChI InChI=1S/C24H23N3O2/c1-4-29-24(28)18-12-15-22-21(16-18)25-23(27(22)20-8-6-5-7-9-20)17-10-13-19(14-11-17)26(2)3/h5-16H,4H2,1-3H3	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	2.69E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universiti Sains Malaysia Curated by ChEMBL					Assay Description Inhibition of human recombinant C-terminal His-tagged SIRT2 (13 to 319 amino acid) after 45 mins by spectrophotometry relative to control				Eur J Med Chem 83: 448-54 (2014) Article DOI: 10.1016/j.ejmech.2014.06.060 BindingDB Entry DOI: 10.7270/Q20P11MC
					More data for this Ligand-Target Pair
Tyrosine-protein kinase CSK (Homo sapiens (Human))	BDBM110207 (t-Butyl [2-{5-(2-hydroxy-4-methoxybenzoyl)-2-oxopy...) Show SMILES COc1ccc(C(=O)c2ccc(=O)n(CCNC(=O)OC(C)(C)C)c2)c(O)c1 Show InChI InChI=1S/C20H24N2O6/c1-20(2,3)28-19(26)21-9-10-22-12-13(5-8-17(22)24)18(25)15-7-6-14(27-4)11-16(15)23/h5-8,11-12,23H,9-10H2,1-4H3,(H,21,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.76E+4	n/a	n/a	n/a	n/a	7.5	25
University of Delhi, Delhi 110007, India					Assay Description The kinase reaction was initiated with the incubation of the 2.5 µL of the reaction cocktail (0.7 nM of His6-Src kinase domain in kinase buffer)...				Bioorg Chem 53: 75-82 (2014) Article DOI: 10.1016/j.bioorg.2014.02.001 BindingDB Entry DOI: 10.7270/Q2HX1BBK
					More data for this Ligand-Target Pair
Tyrosine-protein kinase CSK (Homo sapiens (Human))	BDBM110202 (5-(2,4-Dihydroxybenzoyl)-1-hexylpyridin-2(1H)-one ...) Show SMILES CCCCCCn1cc(ccc1=O)C(=O)c1ccc(O)cc1O Show InChI InChI=1S/C18H21NO4/c1-2-3-4-5-10-19-12-13(6-9-17(19)22)18(23)15-8-7-14(20)11-16(15)21/h6-9,11-12,20-21H,2-5,10H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.77E+4	n/a	n/a	n/a	n/a	7.5	25
University of Delhi, Delhi 110007, India					Assay Description The kinase reaction was initiated with the incubation of the 2.5 µL of the reaction cocktail (0.7 nM of His6-Src kinase domain in kinase buffer)...				Bioorg Chem 53: 75-82 (2014) Article DOI: 10.1016/j.bioorg.2014.02.001 BindingDB Entry DOI: 10.7270/Q2HX1BBK
					More data for this Ligand-Target Pair
Tyrosine-protein kinase CSK (Homo sapiens (Human))	BDBM110198 (1-Hexyl-5-(2-hydroxybenzoyl)pyridin-2(1H)-one (28)) Show SMILES CCCCCCn1cc(ccc1=O)C(=O)c1ccccc1O Show InChI InChI=1S/C18H21NO3/c1-2-3-4-7-12-19-13-14(10-11-17(19)21)18(22)15-8-5-6-9-16(15)20/h5-6,8-11,13,20H,2-4,7,12H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.81E+4	n/a	n/a	n/a	n/a	7.5	25
University of Delhi, Delhi 110007, India					Assay Description The kinase reaction was initiated with the incubation of the 2.5 µL of the reaction cocktail (0.7 nM of His6-Src kinase domain in kinase buffer)...				Bioorg Chem 53: 75-82 (2014) Article DOI: 10.1016/j.bioorg.2014.02.001 BindingDB Entry DOI: 10.7270/Q2HX1BBK
					More data for this Ligand-Target Pair
Tyrosine-protein kinase CSK (Homo sapiens (Human))	BDBM110201 (1-[2-(Dimethylamino)ethyl]-5-(2-hydroxybenzoyl)pyr...) Show SMILES CN(C)CCn1cc(ccc1=O)C(=O)c1ccccc1O Show InChI InChI=1S/C16H18N2O3/c1-17(2)9-10-18-11-12(7-8-15(18)20)16(21)13-5-3-4-6-14(13)19/h3-8,11,19H,9-10H2,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.82E+4	n/a	n/a	n/a	n/a	7.5	25
University of Delhi, Delhi 110007, India					Assay Description The kinase reaction was initiated with the incubation of the 2.5 µL of the reaction cocktail (0.7 nM of His6-Src kinase domain in kinase buffer)...				Bioorg Chem 53: 75-82 (2014) Article DOI: 10.1016/j.bioorg.2014.02.001 BindingDB Entry DOI: 10.7270/Q2HX1BBK
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM99917 (4-tert-butyl-N-(4-(5-(dimethylamino)pentanamido)ph...) Show SMILES CN(C)CCCCC(=O)Nc1ccc(NC(=S)NC(=O)c2ccc(cc2)C(C)(C)C)cc1 Show InChI InChI=1S/C25H34N4O2S/c1-25(2,3)19-11-9-18(10-12-19)23(31)28-24(32)27-21-15-13-20(14-16-21)26-22(30)8-6-7-17-29(4)5/h9-16H,6-8,17H2,1-5H3,(H,26,30)(H2,27,28,31,32)/p+1	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	2.97E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universiti Sains Malaysia Curated by ChEMBL					Assay Description Inhibition of human recombinant C-terminal His-tagged SIRT2 (13 to 319 amino acid) after 45 mins by spectrophotometry relative to control				Eur J Med Chem 83: 448-54 (2014) Article DOI: 10.1016/j.ejmech.2014.06.060 BindingDB Entry DOI: 10.7270/Q20P11MC
					More data for this Ligand-Target Pair
Tyrosine-protein kinase CSK (Homo sapiens (Human))	BDBM110204 (1-Hexyl-5-(2-hydroxy-4-methoxybenzoyl)pyridin-2(1H...) Show SMILES CCCCCCn1cc(ccc1=O)C(=O)c1ccc(OC)cc1O Show InChI InChI=1S/C19H23NO4/c1-3-4-5-6-11-20-13-14(7-10-18(20)22)19(23)16-9-8-15(24-2)12-17(16)21/h7-10,12-13,21H,3-6,11H2,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.41E+4	n/a	n/a	n/a	n/a	7.5	25
University of Delhi, Delhi 110007, India					Assay Description The kinase reaction was initiated with the incubation of the 2.5 µL of the reaction cocktail (0.7 nM of His6-Src kinase domain in kinase buffer)...				Bioorg Chem 53: 75-82 (2014) Article DOI: 10.1016/j.bioorg.2014.02.001 BindingDB Entry DOI: 10.7270/Q2HX1BBK
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50360661 (CHEMBL1933756) Show SMILES COc1ccc(cc1)-n1nc2CC(C)(C)CC(=O)c2c1-c1ccc(cc1)C(C)(C)C Show InChI InChI=1S/C26H30N2O2/c1-25(2,3)18-9-7-17(8-10-18)24-23-21(15-26(4,5)16-22(23)29)27-28(24)19-11-13-20(30-6)14-12-19/h7-14H,15-16H2,1-6H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.51E+4	n/a	n/a	n/a	n/a	n/a	n/a
Birla Institute of Technology and Science Curated by ChEMBL					Assay Description Inhibition of His6-tagged c-Src kinase domain using AEEEIYGEFEAKKKK as substrate pre-incubated for 10 mins before substrate addition measured after 3...				Bioorg Med Chem Lett 22: 410-4 (2011) Article DOI: 10.1016/j.bmcl.2011.10.124 BindingDB Entry DOI: 10.7270/Q23X872P
					More data for this Ligand-Target Pair
Tyrosine-protein kinase CSK (Homo sapiens (Human))	BDBM110214 ((E)-5-[(2-Hydroxyphenyl)(isopropylimino)methyl]-1-...) Show SMILES CC(C)\N=C(/c1ccc(=O)n(c1)C(C)C)c1ccccc1O Show InChI InChI=1S/C18H22N2O2/c1-12(2)19-18(15-7-5-6-8-16(15)21)14-9-10-17(22)20(11-14)13(3)4/h5-13,21H,1-4H3/b19-18+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.79E+4	n/a	n/a	n/a	n/a	7.5	25
University of Delhi, Delhi 110007, India					Assay Description The kinase reaction was initiated with the incubation of the 2.5 µL of the reaction cocktail (0.7 nM of His6-Src kinase domain in kinase buffer)...				Bioorg Chem 53: 75-82 (2014) Article DOI: 10.1016/j.bioorg.2014.02.001 BindingDB Entry DOI: 10.7270/Q2HX1BBK
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50445823 (CHEMBL3105180) Show SMILES CCOC(=O)c1ccc2n(CCO)c(nc2c1)-c1ccc(cc1)N(C)C Show InChI InChI=1S/C20H23N3O3/c1-4-26-20(25)15-7-10-18-17(13-15)21-19(23(18)11-12-24)14-5-8-16(9-6-14)22(2)3/h5-10,13,24H,4,11-12H2,1-3H3	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	4.51E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universiti Sains Malaysia Curated by ChEMBL					Assay Description Inhibition of human recombinant C-terminal His-tagged SIRT2 (13 to 319) after 45 mins by fluorescence assay				Bioorg Med Chem 22: 703-10 (2014) Article DOI: 10.1016/j.bmc.2013.12.029 BindingDB Entry DOI: 10.7270/Q2G1629F
					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	4.59E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universiti Sains Malaysia Curated by ChEMBL					Assay Description Inhibition of human recombinant C-terminal His-tagged SIRT2 (13 to 319 amino acid) after 45 mins by spectrophotometry relative to control				Eur J Med Chem 83: 448-54 (2014) Article DOI: 10.1016/j.ejmech.2014.06.060 BindingDB Entry DOI: 10.7270/Q20P11MC
					More data for this Ligand-Target Pair
Tyrosine-protein kinase CSK (Homo sapiens (Human))	BDBM110205 (5-(2-Hydroxy-4-methoxybenzoyl)-1-isopropylpyridin-...) Show SMILES COc1ccc(C(=O)c2ccc(=O)n(c2)C(C)C)c(O)c1 Show InChI InChI=1S/C16H17NO4/c1-10(2)17-9-11(4-7-15(17)19)16(20)13-6-5-12(21-3)8-14(13)18/h4-10,18H,1-3H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.70E+4	n/a	n/a	n/a	n/a	7.5	25
University of Delhi, Delhi 110007, India					Assay Description The kinase reaction was initiated with the incubation of the 2.5 µL of the reaction cocktail (0.7 nM of His6-Src kinase domain in kinase buffer)...				Bioorg Chem 53: 75-82 (2014) Article DOI: 10.1016/j.bioorg.2014.02.001 BindingDB Entry DOI: 10.7270/Q2HX1BBK
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (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 NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	4.79E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universiti Sains Malaysia Curated by ChEMBL					Assay Description Inhibition of human recombinant N-terminal GST-tagged SIRT1 (193 to 741) after 45 mins by fluorescence assay				Bioorg Med Chem 22: 703-10 (2014) Article DOI: 10.1016/j.bmc.2013.12.029 BindingDB Entry DOI: 10.7270/Q2G1629F
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (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 NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	4.79E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universiti Sains Malaysia Curated by ChEMBL					Assay Description Inhibition of human recombinant N-terminal GST-tagged SIRT1 (193 to 741 amino acid) after 45 mins by spectrophotometry relative to control				Eur J Med Chem 83: 448-54 (2014) Article DOI: 10.1016/j.ejmech.2014.06.060 BindingDB Entry DOI: 10.7270/Q20P11MC
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50021513 (CHEMBL3290218) Show SMILES CCOC(=O)c1ccc2n(c(nc2c1)-c1ccc(cc1)N(C)C)-c1ccccc1 Show InChI InChI=1S/C24H23N3O2/c1-4-29-24(28)18-12-15-22-21(16-18)25-23(27(22)20-8-6-5-7-9-20)17-10-13-19(14-11-17)26(2)3/h5-16H,4H2,1-3H3	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	4.91E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universiti Sains Malaysia Curated by ChEMBL					Assay Description Inhibition of human recombinant N-terminal GST-tagged SIRT1 (193 to 741 amino acid) after 45 mins by spectrophotometry relative to control				Eur J Med Chem 83: 448-54 (2014) Article DOI: 10.1016/j.ejmech.2014.06.060 BindingDB Entry DOI: 10.7270/Q20P11MC
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50345171 (CHEMBL1779738 | N-((1H-Indol-3-yl)(phenyl)methyl)-...) Show SMILES CN(C(c1c[nH]c2ccccc12)c1ccccc1)c1ccccc1 Show InChI InChI=1S/C22H20N2/c1-24(18-12-6-3-7-13-18)22(17-10-4-2-5-11-17)20-16-23-21-15-9-8-14-19(20)21/h2-16,22-23H,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.06E+4	n/a	n/a	n/a	n/a	n/a	n/a
India Institute of Technology and Science Curated by ChEMBL					Assay Description Inhibition of c-Src using AEEEIYGEFEAKKKK substrate by fluorescence intensity assay				Bioorg Med Chem Lett 21: 3511-4 (2011) Article DOI: 10.1016/j.bmcl.2011.05.010 BindingDB Entry DOI: 10.7270/Q2R49R44
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50360642 (CHEMBL1933738) Show SMILES CC1(C)Cc2nn(c(c2C(=O)C1)-c1ccc(Cl)c(Cl)c1)-c1cccc(Cl)c1 Show InChI InChI=1S/C21H17Cl3N2O/c1-21(2)10-17-19(18(27)11-21)20(12-6-7-15(23)16(24)8-12)26(25-17)14-5-3-4-13(22)9-14/h3-9H,10-11H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.07E+4	n/a	n/a	n/a	n/a	n/a	n/a
Birla Institute of Technology and Science Curated by ChEMBL					Assay Description Inhibition of His6-tagged c-Src kinase domain using AEEEIYGEFEAKKKK as substrate pre-incubated for 10 mins before substrate addition measured after 3...				Bioorg Med Chem Lett 22: 410-4 (2011) Article DOI: 10.1016/j.bmcl.2011.10.124 BindingDB Entry DOI: 10.7270/Q23X872P
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50021512 (CHEMBL3290210) Show SMILES CCOC(=O)c1ccc2n(CCCN3CCCC3=O)c(nc2c1)-c1ccc(cc1)N(C)C Show InChI InChI=1S/C25H30N4O3/c1-4-32-25(31)19-10-13-22-21(17-19)26-24(18-8-11-20(12-9-18)27(2)3)29(22)16-6-15-28-14-5-7-23(28)30/h8-13,17H,4-7,14-16H2,1-3H3	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	5.28E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universiti Sains Malaysia Curated by ChEMBL					Assay Description Inhibition of human recombinant C-terminal His-tagged SIRT2 (13 to 319 amino acid) after 45 mins by spectrophotometry relative to control				Eur J Med Chem 83: 448-54 (2014) Article DOI: 10.1016/j.ejmech.2014.06.060 BindingDB Entry DOI: 10.7270/Q20P11MC
					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	5.29E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universiti Sains Malaysia Curated by ChEMBL					Assay Description Inhibition of human recombinant C-terminal His-tagged SIRT2 (13 to 319) after 45 mins by fluorescence assay				Bioorg Med Chem 22: 703-10 (2014) Article DOI: 10.1016/j.bmc.2013.12.029 BindingDB Entry DOI: 10.7270/Q2G1629F
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50445821 (CHEMBL3105182) Show SMILES CCOC(=O)c1ccc2n(CCO)c(nc2c1)-c1ccc2OCOc2c1 Show InChI InChI=1S/C19H18N2O5/c1-2-24-19(23)13-3-5-15-14(9-13)20-18(21(15)7-8-22)12-4-6-16-17(10-12)26-11-25-16/h3-6,9-10,22H,2,7-8,11H2,1H3	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.61E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universiti Sains Malaysia Curated by ChEMBL					Assay Description Inhibition of human recombinant C-terminal His-tagged SIRT2 (13 to 319) after 45 mins by fluorescence assay				Bioorg Med Chem 22: 703-10 (2014) Article DOI: 10.1016/j.bmc.2013.12.029 BindingDB Entry DOI: 10.7270/Q2G1629F
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50360660 (CHEMBL1933755) Show SMILES Cc1ccc(cc1)-n1nc2CCCC(=O)c2c1C1CCCCC1 Show InChI InChI=1S/C20H24N2O/c1-14-10-12-16(13-11-14)22-20(15-6-3-2-4-7-15)19-17(21-22)8-5-9-18(19)23/h10-13,15H,2-9H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.77E+4	n/a	n/a	n/a	n/a	n/a	n/a
Birla Institute of Technology and Science Curated by ChEMBL					Assay Description Inhibition of His6-tagged c-Src kinase domain using AEEEIYGEFEAKKKK as substrate pre-incubated for 10 mins before substrate addition measured after 3...				Bioorg Med Chem Lett 22: 410-4 (2011) Article DOI: 10.1016/j.bmcl.2011.10.124 BindingDB Entry DOI: 10.7270/Q23X872P
					More data for this Ligand-Target Pair
Tyrosine-protein kinase CSK (Homo sapiens (Human))	BDBM110203 (t-Butyl [2-{5-(2,4-dihydroxybenzoyl)-2-oxopyridin-...) Show SMILES CC(C)(C)OC(=O)NCCn1cc(ccc1=O)C(=O)c1ccc(O)cc1O Show InChI InChI=1S/C19H22N2O6/c1-19(2,3)27-18(26)20-8-9-21-11-12(4-7-16(21)24)17(25)14-6-5-13(22)10-15(14)23/h4-7,10-11,22-23H,8-9H2,1-3H3,(H,20,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.78E+4	n/a	n/a	n/a	n/a	7.5	25
University of Delhi, Delhi 110007, India					Assay Description The kinase reaction was initiated with the incubation of the 2.5 µL of the reaction cocktail (0.7 nM of His6-Src kinase domain in kinase buffer)...				Bioorg Chem 53: 75-82 (2014) Article DOI: 10.1016/j.bioorg.2014.02.001 BindingDB Entry DOI: 10.7270/Q2HX1BBK
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM99917 (4-tert-butyl-N-(4-(5-(dimethylamino)pentanamido)ph...) Show SMILES CN(C)CCCCC(=O)Nc1ccc(NC(=S)NC(=O)c2ccc(cc2)C(C)(C)C)cc1 Show InChI InChI=1S/C25H34N4O2S/c1-25(2,3)19-11-9-18(10-12-19)23(31)28-24(32)27-21-15-13-20(14-16-21)26-22(30)8-6-7-17-29(4)5/h9-16H,6-8,17H2,1-5H3,(H,26,30)(H2,27,28,31,32)/p+1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	5.81E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universiti Sains Malaysia Curated by ChEMBL					Assay Description Inhibition of human recombinant N-terminal GST-tagged SIRT1 (193 to 741 amino acid) after 45 mins by spectrophotometry relative to control				Eur J Med Chem 83: 448-54 (2014) Article DOI: 10.1016/j.ejmech.2014.06.060 BindingDB Entry DOI: 10.7270/Q20P11MC
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50345179 (CHEMBL1779746 | N-((1H-Indol-3-yl)(3-nitrophenyl)m...) Show SMILES CN(C(c1c[nH]c2ccccc12)c1cccc(c1)[N+]([O-])=O)c1ccccc1 Show InChI InChI=1S/C22H19N3O2/c1-24(17-9-3-2-4-10-17)22(16-8-7-11-18(14-16)25(26)27)20-15-23-21-13-6-5-12-19(20)21/h2-15,22-23H,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.83E+4	n/a	n/a	n/a	n/a	n/a	n/a
India Institute of Technology and Science Curated by ChEMBL					Assay Description Inhibition of c-Src using AEEEIYGEFEAKKKK substrate by fluorescence intensity assay				Bioorg Med Chem Lett 21: 3511-4 (2011) Article DOI: 10.1016/j.bmcl.2011.05.010 BindingDB Entry DOI: 10.7270/Q2R49R44
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50360659 (CHEMBL1933754) Show SMILES Clc1cccc(c1)-n1nc2CCCC(=O)c2c1C1CCCCC1 Show InChI InChI=1S/C19H21ClN2O/c20-14-8-4-9-15(12-14)22-19(13-6-2-1-3-7-13)18-16(21-22)10-5-11-17(18)23/h4,8-9,12-13H,1-3,5-7,10-11H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	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
Birla Institute of Technology and Science Curated by ChEMBL					Assay Description Inhibition of His6-tagged c-Src kinase domain using AEEEIYGEFEAKKKK as substrate pre-incubated for 10 mins before substrate addition measured after 3...				Bioorg Med Chem Lett 22: 410-4 (2011) Article DOI: 10.1016/j.bmcl.2011.10.124 BindingDB Entry DOI: 10.7270/Q23X872P
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50445823 (CHEMBL3105180) Show SMILES CCOC(=O)c1ccc2n(CCO)c(nc2c1)-c1ccc(cc1)N(C)C Show InChI InChI=1S/C20H23N3O3/c1-4-26-20(25)15-7-10-18-17(13-15)21-19(23(18)11-12-24)14-5-8-16(9-6-14)22(2)3/h5-10,13,24H,4,11-12H2,1-3H3	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	5.84E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universiti Sains Malaysia Curated by ChEMBL					Assay Description Inhibition of human recombinant N-terminal GST-tagged SIRT1 (193 to 741) after 45 mins by fluorescence assay				Bioorg Med Chem 22: 703-10 (2014) Article DOI: 10.1016/j.bmc.2013.12.029 BindingDB Entry DOI: 10.7270/Q2G1629F
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50021512 (CHEMBL3290210) Show SMILES CCOC(=O)c1ccc2n(CCCN3CCCC3=O)c(nc2c1)-c1ccc(cc1)N(C)C Show InChI InChI=1S/C25H30N4O3/c1-4-32-25(31)19-10-13-22-21(17-19)26-24(18-8-11-20(12-9-18)27(2)3)29(22)16-6-15-28-14-5-7-23(28)30/h8-13,17H,4-7,14-16H2,1-3H3	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	6.03E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universiti Sains Malaysia Curated by ChEMBL					Assay Description Inhibition of human recombinant N-terminal GST-tagged SIRT1 (193 to 741 amino acid) after 45 mins by spectrophotometry relative to control				Eur J Med Chem 83: 448-54 (2014) Article DOI: 10.1016/j.ejmech.2014.06.060 BindingDB Entry DOI: 10.7270/Q20P11MC
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50445822 (CHEMBL3105181) Show SMILES CCOC(=O)c1ccc2n(CCO)c(nc2c1)-c1ccc(cc1)N1CCCCC1 Show InChI InChI=1S/C23H27N3O3/c1-2-29-23(28)18-8-11-21-20(16-18)24-22(26(21)14-15-27)17-6-9-19(10-7-17)25-12-4-3-5-13-25/h6-11,16,27H,2-5,12-15H2,1H3	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	6.03E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universiti Sains Malaysia Curated by ChEMBL					Assay Description Inhibition of human recombinant C-terminal His-tagged SIRT2 (13 to 319) after 45 mins by fluorescence assay				Bioorg Med Chem 22: 703-10 (2014) Article DOI: 10.1016/j.bmc.2013.12.029 BindingDB Entry DOI: 10.7270/Q2G1629F
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50345178 (CHEMBL1779745 | N-Methyl-N-((1-methyl-1H-indol-3-y...) Show SMILES CN(C(c1cn(C)c2ccccc12)c1ccc(C)cc1)c1ccccc1 Show InChI InChI=1S/C24H24N2/c1-18-13-15-19(16-14-18)24(26(3)20-9-5-4-6-10-20)22-17-25(2)23-12-8-7-11-21(22)23/h4-17,24H,1-3H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.05E+4	n/a	n/a	n/a	n/a	n/a	n/a
India Institute of Technology and Science Curated by ChEMBL					Assay Description Inhibition of c-Src using AEEEIYGEFEAKKKK substrate by fluorescence intensity assay				Bioorg Med Chem Lett 21: 3511-4 (2011) Article DOI: 10.1016/j.bmcl.2011.05.010 BindingDB Entry DOI: 10.7270/Q2R49R44
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-2 (Homo sapiens (Human))	BDBM50021528 (CHEMBL3290220) Show SMILES CCOC(=O)c1ccc2n(c(nc2c1)-c1ccc(C)cc1)-c1ccccc1 Show InChI InChI=1S/C23H20N2O2/c1-3-27-23(26)18-13-14-21-20(15-18)24-22(17-11-9-16(2)10-12-17)25(21)19-7-5-4-6-8-19/h4-15H,3H2,1-2H3	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	6.06E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universiti Sains Malaysia Curated by ChEMBL					Assay Description Inhibition of human recombinant C-terminal His-tagged SIRT2 (13 to 319 amino acid) after 45 mins by spectrophotometry relative to control				Eur J Med Chem 83: 448-54 (2014) Article DOI: 10.1016/j.ejmech.2014.06.060 BindingDB Entry DOI: 10.7270/Q20P11MC
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50360641 (CHEMBL1933737) Show SMILES CC1(C)Cc2nn(c(c2C(=O)C1)-c1ccc(Cl)c(Cl)c1)-c1ccccc1 Show InChI InChI=1S/C21H18Cl2N2O/c1-21(2)11-17-19(18(26)12-21)20(13-8-9-15(22)16(23)10-13)25(24-17)14-6-4-3-5-7-14/h3-10H,11-12H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.21E+4	n/a	n/a	n/a	n/a	n/a	n/a
Birla Institute of Technology and Science Curated by ChEMBL					Assay Description Inhibition of His6-tagged c-Src kinase domain using AEEEIYGEFEAKKKK as substrate pre-incubated for 10 mins before substrate addition measured after 3...				Bioorg Med Chem Lett 22: 410-4 (2011) Article DOI: 10.1016/j.bmcl.2011.10.124 BindingDB Entry DOI: 10.7270/Q23X872P
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50360648 (CHEMBL1933743) Show SMILES Clc1ccc(cc1Cl)-c1c2c(CCCC2=O)nn1-c1ccccc1 Show InChI InChI=1S/C19H14Cl2N2O/c20-14-10-9-12(11-15(14)21)19-18-16(7-4-8-17(18)24)22-23(19)13-5-2-1-3-6-13/h1-3,5-6,9-11H,4,7-8H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.58E+4	n/a	n/a	n/a	n/a	n/a	n/a
Birla Institute of Technology and Science Curated by ChEMBL					Assay Description Inhibition of His6-tagged c-Src kinase domain using AEEEIYGEFEAKKKK as substrate pre-incubated for 10 mins before substrate addition measured after 3...				Bioorg Med Chem Lett 22: 410-4 (2011) Article DOI: 10.1016/j.bmcl.2011.10.124 BindingDB Entry DOI: 10.7270/Q23X872P
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50360638 (CHEMBL1933734) Show SMILES CC1(C)Cc2nn(c(c2C(=O)C1)-c1ccc(Cl)c(Cl)c1)-c1ccc(O)cc1 Show InChI InChI=1S/C21H18Cl2N2O2/c1-21(2)10-17-19(18(27)11-21)20(12-3-8-15(22)16(23)9-12)25(24-17)13-4-6-14(26)7-5-13/h3-9,26H,10-11H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.66E+4	n/a	n/a	n/a	n/a	n/a	n/a
Birla Institute of Technology and Science Curated by ChEMBL					Assay Description Inhibition of His6-tagged c-Src kinase domain using AEEEIYGEFEAKKKK as substrate pre-incubated for 10 mins before substrate addition measured after 3...				Bioorg Med Chem Lett 22: 410-4 (2011) Article DOI: 10.1016/j.bmcl.2011.10.124 BindingDB Entry DOI: 10.7270/Q23X872P
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50345180 (CHEMBL1779747 | N-((5-Bromo-1H-indol-3-yl)(phenyl)...) Show SMILES CN(C(c1c[nH]c2ccc(Br)cc12)c1ccccc1)c1ccccc1 Show InChI InChI=1S/C22H19BrN2/c1-25(18-10-6-3-7-11-18)22(16-8-4-2-5-9-16)20-15-24-21-13-12-17(23)14-19(20)21/h2-15,22,24H,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.16E+4	n/a	n/a	n/a	n/a	n/a	n/a
India Institute of Technology and Science Curated by ChEMBL					Assay Description Inhibition of c-Src using AEEEIYGEFEAKKKK substrate by fluorescence intensity assay				Bioorg Med Chem Lett 21: 3511-4 (2011) Article DOI: 10.1016/j.bmcl.2011.05.010 BindingDB Entry DOI: 10.7270/Q2R49R44
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50360654 (CHEMBL1933749) Show SMILES Cc1ccc(cc1Cl)-c1c2c(CC(C)(C)CC2=O)nn1-c1ccncc1 Show InChI InChI=1S/C21H20ClN3O/c1-13-4-5-14(10-16(13)22)20-19-17(11-21(2,3)12-18(19)26)24-25(20)15-6-8-23-9-7-15/h4-10H,11-12H2,1-3H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.43E+4	n/a	n/a	n/a	n/a	n/a	n/a
Birla Institute of Technology and Science Curated by ChEMBL					Assay Description Inhibition of His6-tagged c-Src kinase domain using AEEEIYGEFEAKKKK as substrate pre-incubated for 10 mins before substrate addition measured after 3...				Bioorg Med Chem Lett 22: 410-4 (2011) Article DOI: 10.1016/j.bmcl.2011.10.124 BindingDB Entry DOI: 10.7270/Q23X872P
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50445822 (CHEMBL3105181) Show SMILES CCOC(=O)c1ccc2n(CCO)c(nc2c1)-c1ccc(cc1)N1CCCCC1 Show InChI InChI=1S/C23H27N3O3/c1-2-29-23(28)18-8-11-21-20(16-18)24-22(26(21)14-15-27)17-6-9-19(10-7-17)25-12-4-3-5-13-25/h6-11,16,27H,2-5,12-15H2,1H3	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	7.45E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universiti Sains Malaysia Curated by ChEMBL					Assay Description Inhibition of human recombinant N-terminal GST-tagged SIRT1 (193 to 741) after 45 mins by fluorescence assay				Bioorg Med Chem 22: 703-10 (2014) Article DOI: 10.1016/j.bmc.2013.12.029 BindingDB Entry DOI: 10.7270/Q2G1629F
					More data for this Ligand-Target Pair

Displayed 1 to 50 (of 94 total )  |  Next  |  Last  >>

Jump to: