Compile Data Set for Download or QSAR

Found 60 hits with Last Name = 'ueda' 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
Histone deacetylase 8 (Homo sapiens (Human))	BDBM50399672 (CHEMBL2178342) Show SMILES ONC(=O)c1cccc(c1)-c1cn(CSc2ccccc2)nn1 Show InChI InChI=1S/C16H14N4O2S/c21-16(18-22)13-6-4-5-12(9-13)15-10-20(19-17-15)11-23-14-7-2-1-3-8-14/h1-10,22H,11H2,(H,18,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto Prefectural University of Medicine Curated by ChEMBL					Assay Description Inhibition of HDAC8 by fluorometric assay				J Med Chem 55: 9562-75 (2012) Article DOI: 10.1021/jm300837y BindingDB Entry DOI: 10.7270/Q25X2B3Q
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM50399673 (CHEMBL2178343) Show SMILES ONC(=O)c1cccc(c1)-c1cn(CCc2ccsc2)nn1 Show InChI InChI=1S/C15H14N4O2S/c20-15(17-21)13-3-1-2-12(8-13)14-9-19(18-16-14)6-4-11-5-7-22-10-11/h1-3,5,7-10,21H,4,6H2,(H,17,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto Prefectural University of Medicine Curated by ChEMBL					Assay Description Inhibition of HDAC8 by fluorometric assay				J Med Chem 55: 9562-75 (2012) Article DOI: 10.1021/jm300837y BindingDB Entry DOI: 10.7270/Q25X2B3Q
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM50399674 (CHEMBL2178344) Show SMILES ONC(=O)c1cccc(c1)-c1cn(CCc2ccccc2)nn1 Show InChI InChI=1S/C17H16N4O2/c22-17(19-23)15-8-4-7-14(11-15)16-12-21(20-18-16)10-9-13-5-2-1-3-6-13/h1-8,11-12,23H,9-10H2,(H,19,22)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	180	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto Prefectural University of Medicine Curated by ChEMBL					Assay Description Inhibition of HDAC8 by fluorometric assay				J Med Chem 55: 9562-75 (2012) Article DOI: 10.1021/jm300837y BindingDB Entry DOI: 10.7270/Q25X2B3Q
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Homo sapiens (Human))	BDBM19149 (CHEMBL98 | N-hydroxy-N'-phenyloctanediamide | SAHA...) Show SMILES ONC(=O)CCCCCCC(=O)Nc1ccccc1 Show InChI InChI=1S/C14H20N2O3/c17-13(15-12-8-4-3-5-9-12)10-6-1-2-7-11-14(18)16-19/h3-5,8-9,19H,1-2,6-7,10-11H2,(H,15,17)(H,16,18)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	DrugBank Article PubMed	n/a	n/a	210	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto Prefectural University of Medicine Curated by ChEMBL					Assay Description Inhibition of HDAC6 by fluorometric assay				J Med Chem 55: 9562-75 (2012) Article DOI: 10.1021/jm300837y BindingDB Entry DOI: 10.7270/Q25X2B3Q
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM19149 (CHEMBL98 | N-hydroxy-N'-phenyloctanediamide | SAHA...) Show SMILES ONC(=O)CCCCCCC(=O)Nc1ccccc1 Show InChI InChI=1S/C14H20N2O3/c17-13(15-12-8-4-3-5-9-12)10-6-1-2-7-11-14(18)16-19/h3-5,8-9,19H,1-2,6-7,10-11H2,(H,15,17)(H,16,18)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	DrugBank PDB Article PubMed	n/a	n/a	270	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto Prefectural University of Medicine Curated by ChEMBL					Assay Description Inhibition of HDAC1 by fluorometric assay				J Med Chem 55: 9562-75 (2012) Article DOI: 10.1021/jm300837y BindingDB Entry DOI: 10.7270/Q25X2B3Q
					More data for this Ligand-Target Pair				3D Structure (crystal)
Histone deacetylase 8 (Homo sapiens (Human))	BDBM50397360 (CHEMBL2170177 | US10188756, Compound CN110) Show SMILES COc1ccc(Cn2ccc3ccc(cc23)C(=O)NO)cc1 Show InChI InChI=1S/C17H16N2O3/c1-22-15-6-2-12(3-7-15)11-19-9-8-13-4-5-14(10-16(13)19)17(20)18-21/h2-10,21H,11H2,1H3,(H,18,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	310	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto Prefectural University of Medicine Curated by ChEMBL					Assay Description Inhibition of HDAC8 by fluorometric assay				J Med Chem 55: 9562-75 (2012) Article DOI: 10.1021/jm300837y BindingDB Entry DOI: 10.7270/Q25X2B3Q
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM50399675 (CHEMBL2178345) Show SMILES ONC(=O)c1cccc(c1)-c1cn(Cc2ccccc2)nn1 Show InChI InChI=1S/C16H14N4O2/c21-16(18-22)14-8-4-7-13(9-14)15-11-20(19-17-15)10-12-5-2-1-3-6-12/h1-9,11,22H,10H2,(H,18,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	350	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto Prefectural University of Medicine Curated by ChEMBL					Assay Description Inhibition of HDAC8 by fluorometric assay				J Med Chem 55: 9562-75 (2012) Article DOI: 10.1021/jm300837y BindingDB Entry DOI: 10.7270/Q25X2B3Q
					More data for this Ligand-Target Pair
Snake venom metalloproteinase BaP1 (Bothrops asper)	BDBM50420343 (CHEMBL2089170) Show SMILES CC(C)C[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NO |r| Show InChI InChI=1S/C24H32N4O4/c1-16(2)13-20(26-22(29)19(25)14-17-9-5-3-6-10-17)23(30)27-21(24(31)28-32)15-18-11-7-4-8-12-18/h3-12,16,19-21,32H,13-15,25H2,1-2H3,(H,26,29)(H,27,30)(H,28,31)/t19-,20-,21-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	500	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of snake venom BaP1 using Abz-Ala-Gly-Leu-Ala-Nba as substrate incubated for 30 mins prior to substrate addition by fluorescence spectroph...				ACS Med Chem Lett 3: 540-543 (2012) Article DOI: 10.1021/ml300068r BindingDB Entry DOI: 10.7270/Q2542PVS
					More data for this Ligand-Target Pair
Histone deacetylase 2 (Homo sapiens (Human))	BDBM19149 (CHEMBL98 | N-hydroxy-N'-phenyloctanediamide | SAHA...) Show SMILES ONC(=O)CCCCCCC(=O)Nc1ccccc1 Show InChI InChI=1S/C14H20N2O3/c17-13(15-12-8-4-3-5-9-12)10-6-1-2-7-11-14(18)16-19/h3-5,8-9,19H,1-2,6-7,10-11H2,(H,15,17)(H,16,18)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	DrugBank PDB Article PubMed	n/a	n/a	780	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto Prefectural University of Medicine Curated by ChEMBL					Assay Description Inhibition of HDAC2 by fluorometric assay				J Med Chem 55: 9562-75 (2012) Article DOI: 10.1021/jm300837y BindingDB Entry DOI: 10.7270/Q25X2B3Q
					More data for this Ligand-Target Pair				3D Structure (crystal)
Histone deacetylase 6 (Homo sapiens (Human))	BDBM50399673 (CHEMBL2178343) Show SMILES ONC(=O)c1cccc(c1)-c1cn(CCc2ccsc2)nn1 Show InChI InChI=1S/C15H14N4O2S/c20-15(17-21)13-3-1-2-12(8-13)14-9-19(18-16-14)6-4-11-5-7-22-10-11/h1-3,5,7-10,21H,4,6H2,(H,17,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto Prefectural University of Medicine Curated by ChEMBL					Assay Description Inhibition of HDAC6 by fluorometric assay				J Med Chem 55: 9562-75 (2012) Article DOI: 10.1021/jm300837y BindingDB Entry DOI: 10.7270/Q25X2B3Q
					More data for this Ligand-Target Pair
Snake venom metalloproteinase BaP1 (Bothrops asper)	BDBM50063918 ((2R,3S)-N*4*-Hydroxy-2-isobutyl-N*1*-((S)-1-methyl...) Show SMILES CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)[C@H](CSc1cccs1)C(=O)NO Show InChI InChI=1S/C23H31N3O4S2/c1-15(2)12-17(18(22(28)26-30)14-32-20-10-7-11-31-20)21(27)25-19(23(29)24-3)13-16-8-5-4-6-9-16/h4-11,15,17-19,30H,12-14H2,1-3H3,(H,24,29)(H,25,27)(H,26,28)/t17-,18+,19+/m1/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of snake venom BaP1 using Abz-Ala-Gly-Leu-Ala-Nba as substrate incubated for 30 mins prior to substrate addition by fluorescence spectroph...				ACS Med Chem Lett 3: 540-543 (2012) Article DOI: 10.1021/ml300068r BindingDB Entry DOI: 10.7270/Q2542PVS
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM19149 (CHEMBL98 | N-hydroxy-N'-phenyloctanediamide | SAHA...) Show SMILES ONC(=O)CCCCCCC(=O)Nc1ccccc1 Show InChI InChI=1S/C14H20N2O3/c17-13(15-12-8-4-3-5-9-12)10-6-1-2-7-11-14(18)16-19/h3-5,8-9,19H,1-2,6-7,10-11H2,(H,15,17)(H,16,18)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	DrugBank MMDB PDB Article PubMed	n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto Prefectural University of Medicine Curated by ChEMBL					Assay Description Inhibition of HDAC8 by fluorometric assay				J Med Chem 55: 9562-75 (2012) Article DOI: 10.1021/jm300837y BindingDB Entry DOI: 10.7270/Q25X2B3Q
					More data for this Ligand-Target Pair				3D Structure (crystal)
Lysine-specific histone demethylase 1A (Homo sapiens (Human))	BDBM50346534 (CHEMBL1797705) Show SMILES N[C@H]1C[C@@H]1c1cccc(OCC[C@H](NC(=O)c2ccccc2)C(=O)NCc2ccccc2)c1 |r| Show InChI InChI=1S/C27H29N3O3/c28-24-17-23(24)21-12-7-13-22(16-21)33-15-14-25(30-26(31)20-10-5-2-6-11-20)27(32)29-18-19-8-3-1-4-9-19/h1-13,16,23-25H,14-15,17-18,28H2,(H,29,32)(H,30,31)/t23-,24+,25+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description Inhibition of partially purified LSD1 using histone H3K4Me2 peptide substrate by peroxidase-coupled assay				Bioorg Med Chem 19: 3702-8 (2011) Article DOI: 10.1016/j.bmc.2010.12.024 BindingDB Entry DOI: 10.7270/Q29K4BKJ
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Homo sapiens (Human))	BDBM50399672 (CHEMBL2178342) Show SMILES ONC(=O)c1cccc(c1)-c1cn(CSc2ccccc2)nn1 Show InChI InChI=1S/C16H14N4O2S/c21-16(18-22)13-6-4-5-12(9-13)15-10-20(19-17-15)11-23-14-7-2-1-3-8-14/h1-10,22H,11H2,(H,18,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	2.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto Prefectural University of Medicine Curated by ChEMBL					Assay Description Inhibition of HDAC6 by fluorometric assay				J Med Chem 55: 9562-75 (2012) Article DOI: 10.1021/jm300837y BindingDB Entry DOI: 10.7270/Q25X2B3Q
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Homo sapiens (Human))	BDBM50399674 (CHEMBL2178344) Show SMILES ONC(=O)c1cccc(c1)-c1cn(CCc2ccccc2)nn1 Show InChI InChI=1S/C17H16N4O2/c22-17(19-23)15-8-4-7-14(11-15)16-12-21(20-18-16)10-9-13-5-2-1-3-6-13/h1-8,11-12,23H,9-10H2,(H,19,22)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto Prefectural University of Medicine Curated by ChEMBL					Assay Description Inhibition of HDAC6 by fluorometric assay				J Med Chem 55: 9562-75 (2012) Article DOI: 10.1021/jm300837y BindingDB Entry DOI: 10.7270/Q25X2B3Q
					More data for this Ligand-Target Pair
Snake venom metalloproteinase BaP1 (Bothrops asper)	BDBM50420344 (CHEMBL2089172) Show SMILES [#6]-[#6](-[#6])-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#8] |r| Show InChI InChI=1S/C21H35N7O4/c1-13(2)11-17(27-18(29)15(22)12-14-7-4-3-5-8-14)19(30)26-16(20(31)28-32)9-6-10-25-21(23)24/h3-5,7-8,13,15-17,32H,6,9-12,22H2,1-2H3,(H,26,30)(H,27,29)(H,28,31)(H4,23,24,25)/t15-,16-,17-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of snake venom BaP1 using Abz-Ala-Gly-Leu-Ala-Nba as substrate incubated for 30 mins prior to substrate addition by fluorescence spectroph...				ACS Med Chem Lett 3: 540-543 (2012) Article DOI: 10.1021/ml300068r BindingDB Entry DOI: 10.7270/Q2542PVS
					More data for this Ligand-Target Pair
Lysine-specific histone demethylase 1A (Homo sapiens (Human))	BDBM50346535 (CHEMBL1797706) Show SMILES N[C@@H]1C[C@H]1c1cccc(OCC[C@H](NC(=O)c2ccccc2)C(=O)NCc2ccccc2)c1 |r| Show InChI InChI=1S/C27H29N3O3/c28-24-17-23(24)21-12-7-13-22(16-21)33-15-14-25(30-26(31)20-10-5-2-6-11-20)27(32)29-18-19-8-3-1-4-9-19/h1-13,16,23-25H,14-15,17-18,28H2,(H,29,32)(H,30,31)/t23-,24+,25-/m0/s1	PDB MMDB 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	6.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description Inhibition of partially purified LSD1 using histone H3K4Me2 peptide substrate by peroxidase-coupled assay				Bioorg Med Chem 19: 3702-8 (2011) Article DOI: 10.1016/j.bmc.2010.12.024 BindingDB Entry DOI: 10.7270/Q29K4BKJ
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Homo sapiens (Human))	BDBM50399675 (CHEMBL2178345) Show SMILES ONC(=O)c1cccc(c1)-c1cn(Cc2ccccc2)nn1 Show InChI InChI=1S/C16H14N4O2/c21-16(18-22)14-8-4-7-13(9-14)15-11-20(19-17-15)10-12-5-2-1-3-6-12/h1-9,11,22H,10H2,(H,18,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto Prefectural University of Medicine Curated by ChEMBL					Assay Description Inhibition of HDAC6 by fluorometric assay				J Med Chem 55: 9562-75 (2012) Article DOI: 10.1021/jm300837y BindingDB Entry DOI: 10.7270/Q25X2B3Q
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Homo sapiens (Human))	BDBM50397360 (CHEMBL2170177 | US10188756, Compound CN110) Show SMILES COc1ccc(Cn2ccc3ccc(cc23)C(=O)NO)cc1 Show InChI InChI=1S/C17H16N2O3/c1-22-15-6-2-12(3-7-15)11-19-9-8-13-4-5-14(10-16(13)19)17(20)18-21/h2-10,21H,11H2,1H3,(H,18,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	9.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto Prefectural University of Medicine Curated by ChEMBL					Assay Description Inhibition of HDAC6 by fluorometric assay				J Med Chem 55: 9562-75 (2012) Article DOI: 10.1021/jm300837y BindingDB Entry DOI: 10.7270/Q25X2B3Q
					More data for this Ligand-Target Pair
Histone deacetylase 4 (Homo sapiens (Human))	BDBM19149 (CHEMBL98 | N-hydroxy-N'-phenyloctanediamide | SAHA...) Show SMILES ONC(=O)CCCCCCC(=O)Nc1ccccc1 Show InChI InChI=1S/C14H20N2O3/c17-13(15-12-8-4-3-5-9-12)10-6-1-2-7-11-14(18)16-19/h3-5,8-9,19H,1-2,6-7,10-11H2,(H,15,17)(H,16,18)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto Prefectural University of Medicine Curated by ChEMBL					Assay Description Inhibition of HDAC4 by fluorometric assay				J Med Chem 55: 9562-75 (2012) Article DOI: 10.1021/jm300837y BindingDB Entry DOI: 10.7270/Q25X2B3Q
					More data for this Ligand-Target Pair
Lysine-specific histone demethylase 1A (Homo sapiens (Human))	BDBM50236898 ((1S,2R)-(+)-2-phenylcyclopropylamine | CHEMBL25799...) Show SMILES N[C@H]1C[C@@H]1c1ccccc1 |r| Show InChI InChI=1S/C9H11N/c10-9-6-8(9)7-4-2-1-3-5-7/h1-5,8-9H,6,10H2/t8-,9+/m1/s1	PDB MMDB 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	2.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description Inhibition of partially purified LSD1 using histone H3K4Me2 peptide substrate by peroxidase-coupled assay				Bioorg Med Chem 19: 3702-8 (2011) Article DOI: 10.1016/j.bmc.2010.12.024 BindingDB Entry DOI: 10.7270/Q29K4BKJ
					More data for this Ligand-Target Pair
Histone deacetylase 4 (Homo sapiens (Human))	BDBM50399675 (CHEMBL2178345) Show SMILES ONC(=O)c1cccc(c1)-c1cn(Cc2ccccc2)nn1 Show InChI InChI=1S/C16H14N4O2/c21-16(18-22)14-8-4-7-13(9-14)15-11-20(19-17-15)10-12-5-2-1-3-6-12/h1-9,11,22H,10H2,(H,18,21)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto Prefectural University of Medicine Curated by ChEMBL					Assay Description Inhibition of HDAC4 by fluorometric assay				J Med Chem 55: 9562-75 (2012) Article DOI: 10.1021/jm300837y BindingDB Entry DOI: 10.7270/Q25X2B3Q
					More data for this Ligand-Target Pair
Snake venom metalloproteinase BaP1 (Bothrops asper)	BDBM50420345 (CHEMBL2089171) Show SMILES CC(C)C[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NO |r| Show InChI InChI=1S/C24H32N4O5/c1-15(2)12-20(26-22(30)19(25)13-16-6-4-3-5-7-16)23(31)27-21(24(32)28-33)14-17-8-10-18(29)11-9-17/h3-11,15,19-21,29,33H,12-14,25H2,1-2H3,(H,26,30)(H,27,31)(H,28,32)/t19-,20-,21-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.09E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of snake venom BaP1 using Abz-Ala-Gly-Leu-Ala-Nba as substrate incubated for 30 mins prior to substrate addition by fluorescence spectroph...				ACS Med Chem Lett 3: 540-543 (2012) Article DOI: 10.1021/ml300068r BindingDB Entry DOI: 10.7270/Q2542PVS
					More data for this Ligand-Target Pair
Snake venom metalloproteinase BaP1 (Bothrops asper)	BDBM50420346 (CHEMBL2089166) Show SMILES CC(C)C[C@H](NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)NO |r| Show InChI InChI=1S/C26H33N5O4/c1-16(2)12-22(25(33)30-23(26(34)31-35)13-17-8-4-3-5-9-17)29-24(32)20(27)14-18-15-28-21-11-7-6-10-19(18)21/h3-11,15-16,20,22-23,28,35H,12-14,27H2,1-2H3,(H,29,32)(H,30,33)(H,31,34)/t20-,22-,23-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.42E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of snake venom BaP1 using Abz-Ala-Gly-Leu-Ala-Nba as substrate incubated for 30 mins prior to substrate addition by fluorescence spectroph...				ACS Med Chem Lett 3: 540-543 (2012) Article DOI: 10.1021/ml300068r BindingDB Entry DOI: 10.7270/Q2542PVS
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50399672 (CHEMBL2178342) Show SMILES ONC(=O)c1cccc(c1)-c1cn(CSc2ccccc2)nn1 Show InChI InChI=1S/C16H14N4O2S/c21-16(18-22)13-6-4-5-12(9-13)15-10-20(19-17-15)11-23-14-7-2-1-3-8-14/h1-10,22H,11H2,(H,18,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	3.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto Prefectural University of Medicine Curated by ChEMBL					Assay Description Inhibition of HDAC1 by fluorometric assay				J Med Chem 55: 9562-75 (2012) Article DOI: 10.1021/jm300837y BindingDB Entry DOI: 10.7270/Q25X2B3Q
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50399675 (CHEMBL2178345) Show SMILES ONC(=O)c1cccc(c1)-c1cn(Cc2ccccc2)nn1 Show InChI InChI=1S/C16H14N4O2/c21-16(18-22)14-8-4-7-13(9-14)15-11-20(19-17-15)10-12-5-2-1-3-6-12/h1-9,11,22H,10H2,(H,18,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto Prefectural University of Medicine Curated by ChEMBL					Assay Description Inhibition of HDAC1 by fluorometric assay				J Med Chem 55: 9562-75 (2012) Article DOI: 10.1021/jm300837y BindingDB Entry DOI: 10.7270/Q25X2B3Q
					More data for this Ligand-Target Pair
Histone deacetylase 4 (Homo sapiens (Human))	BDBM50399672 (CHEMBL2178342) Show SMILES ONC(=O)c1cccc(c1)-c1cn(CSc2ccccc2)nn1 Show InChI InChI=1S/C16H14N4O2S/c21-16(18-22)13-6-4-5-12(9-13)15-10-20(19-17-15)11-23-14-7-2-1-3-8-14/h1-10,22H,11H2,(H,18,21)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	4.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto Prefectural University of Medicine Curated by ChEMBL					Assay Description Inhibition of HDAC4 by fluorometric assay				J Med Chem 55: 9562-75 (2012) Article DOI: 10.1021/jm300837y BindingDB Entry DOI: 10.7270/Q25X2B3Q
					More data for this Ligand-Target Pair
Snake venom metalloproteinase BaP1 (Bothrops asper)	BDBM50420347 (CHEMBL2089168) Show SMILES CC(C)C[C@H](NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NO |r| Show InChI InChI=1S/C26H33N5O5/c1-15(2)11-22(25(34)30-23(26(35)31-36)12-16-7-9-18(32)10-8-16)29-24(33)20(27)13-17-14-28-21-6-4-3-5-19(17)21/h3-10,14-15,20,22-23,28,32,36H,11-13,27H2,1-2H3,(H,29,33)(H,30,34)(H,31,35)/t20-,22-,23-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.62E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of snake venom BaP1 using Abz-Ala-Gly-Leu-Ala-Nba as substrate incubated for 30 mins prior to substrate addition by fluorescence spectroph...				ACS Med Chem Lett 3: 540-543 (2012) Article DOI: 10.1021/ml300068r BindingDB Entry DOI: 10.7270/Q2542PVS
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50297161 (2-(Biphenyl-3-ylamino)benzamide | CHEMBL540468) Show SMILES NC(=O)c1ccccc1Nc1cccc(c1)-c1ccccc1 Show InChI InChI=1S/C19H16N2O/c20-19(22)17-11-4-5-12-18(17)21-16-10-6-9-15(13-16)14-7-2-1-3-8-14/h1-13,21H,(H2,20,22)	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
Nagoya City University Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT1 by fluorimetric analysis				Bioorg Med Chem 17: 5900-5 (2009) Article DOI: 10.1016/j.bmc.2009.07.001 BindingDB Entry DOI: 10.7270/Q24X57TQ
					More data for this Ligand-Target Pair
Snake venom metalloproteinase BaP1 (Bothrops asper)	BDBM50420356 (NC 150 | PHENAZOPYRIDINE HYDROCHLORIDE) Show SMILES Nc1ccc(\N=N\c2ccccc2)c(N)n1 Show InChI InChI=1S/C11H11N5/c12-10-7-6-9(11(13)14-10)16-15-8-4-2-1-3-5-8/h1-7H,(H4,12,13,14)/b16-15+	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase DrugBank MCE KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.43E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of snake venom BaP1 using Abz-Ala-Gly-Leu-Ala-Nba as substrate incubated for 30 mins prior to substrate addition by fluorescence spectroph...				ACS Med Chem Lett 3: 540-543 (2012) Article DOI: 10.1021/ml300068r BindingDB Entry DOI: 10.7270/Q2542PVS
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50297159 (2-(phenylamino)benzamide | CHEMBL561194) Show SMILES NC(=O)c1ccccc1Nc1ccccc1 Show InChI InChI=1S/C13H12N2O/c14-13(16)11-8-4-5-9-12(11)15-10-6-2-1-3-7-10/h1-9,15H,(H2,14,16)	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	5.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT1 by fluorimetric analysis				Bioorg Med Chem 17: 5900-5 (2009) Article DOI: 10.1016/j.bmc.2009.07.001 BindingDB Entry DOI: 10.7270/Q24X57TQ
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50297163 (2-(3-Phenoxyphenylamino)benzamide | CHEMBL549853) Show SMILES NC(=O)c1ccccc1Nc1cccc(Oc2ccccc2)c1 Show InChI InChI=1S/C19H16N2O2/c20-19(22)17-11-4-5-12-18(17)21-14-7-6-10-16(13-14)23-15-8-2-1-3-9-15/h1-13,21H,(H2,20,22)	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	5.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT1 by fluorimetric analysis				Bioorg Med Chem 17: 5900-5 (2009) Article DOI: 10.1016/j.bmc.2009.07.001 BindingDB Entry DOI: 10.7270/Q24X57TQ
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50297165 (3-[3-(2-Carbamoylphenylamino)phenyl]acrylic acid |...) Show SMILES NC(=O)c1ccccc1Nc1cccc(\C=C\C(O)=O)c1 Show InChI InChI=1S/C16H14N2O3/c17-16(21)13-6-1-2-7-14(13)18-12-5-3-4-11(10-12)8-9-15(19)20/h1-10,18H,(H2,17,21)(H,19,20)/b9-8+	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	5.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT1 by fluorimetric analysis				Bioorg Med Chem 17: 5900-5 (2009) Article DOI: 10.1016/j.bmc.2009.07.001 BindingDB Entry DOI: 10.7270/Q24X57TQ
					More data for this Ligand-Target Pair
Snake venom metalloproteinase BaP1 (Bothrops asper)	BDBM50420348 (CHEMBL2089167) Show SMILES CC(C)C[C@H](NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)NO |r| Show InChI InChI=1S/C23H31N7O4/c1-13(2)7-19(22(32)29-20(23(33)30-34)9-15-11-25-12-27-15)28-21(31)17(24)8-14-10-26-18-6-4-3-5-16(14)18/h3-6,10-13,17,19-20,26,34H,7-9,24H2,1-2H3,(H,25,27)(H,28,31)(H,29,32)(H,30,33)/t17-,19-,20-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD 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
TBA Curated by ChEMBL					Assay Description Inhibition of snake venom BaP1 using Abz-Ala-Gly-Leu-Ala-Nba as substrate incubated for 30 mins prior to substrate addition by fluorescence spectroph...				ACS Med Chem Lett 3: 540-543 (2012) Article DOI: 10.1021/ml300068r BindingDB Entry DOI: 10.7270/Q2542PVS
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50297166 (2-(3-Hydroxymethylphenylamino)benzamide | CHEMBL56...) Show SMILES NC(=O)c1ccccc1Nc1cccc(CO)c1 Show InChI InChI=1S/C14H14N2O2/c15-14(18)12-6-1-2-7-13(12)16-11-5-3-4-10(8-11)9-17/h1-8,16-17H,9H2,(H2,15,18)	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	6.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT1 by fluorimetric analysis				Bioorg Med Chem 17: 5900-5 (2009) Article DOI: 10.1016/j.bmc.2009.07.001 BindingDB Entry DOI: 10.7270/Q24X57TQ
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50297164 (3-[3-(2-Carbamoylphenylamino)phenyl]acrylic acidme...) Show SMILES COC(=O)\C=C\c1cccc(Nc2ccccc2C(N)=O)c1 Show InChI InChI=1S/C17H16N2O3/c1-22-16(20)10-9-12-5-4-6-13(11-12)19-15-8-3-2-7-14(15)17(18)21/h2-11,19H,1H3,(H2,18,21)/b10-9+	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	6.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT1 by fluorimetric analysis				Bioorg Med Chem 17: 5900-5 (2009) Article DOI: 10.1016/j.bmc.2009.07.001 BindingDB Entry DOI: 10.7270/Q24X57TQ
					More data for this Ligand-Target Pair
Histone deacetylase 2 (Homo sapiens (Human))	BDBM50399675 (CHEMBL2178345) Show SMILES ONC(=O)c1cccc(c1)-c1cn(Cc2ccccc2)nn1 Show InChI InChI=1S/C16H14N4O2/c21-16(18-22)14-8-4-7-13(9-14)15-11-20(19-17-15)10-12-5-2-1-3-6-12/h1-9,11,22H,10H2,(H,18,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto Prefectural University of Medicine Curated by ChEMBL					Assay Description Inhibition of HDAC2 by fluorometric assay				J Med Chem 55: 9562-75 (2012) Article DOI: 10.1021/jm300837y BindingDB Entry DOI: 10.7270/Q25X2B3Q
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50297160 (2-(3-Tolyamino)benzamide | CHEMBL560337) Show SMILES Cc1cccc(Nc2ccccc2C(N)=O)c1 Show InChI InChI=1S/C14H14N2O/c1-10-5-4-6-11(9-10)16-13-8-3-2-7-12(13)14(15)17/h2-9,16H,1H3,(H2,15,17)	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	6.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT1 by fluorimetric analysis				Bioorg Med Chem 17: 5900-5 (2009) Article DOI: 10.1016/j.bmc.2009.07.001 BindingDB Entry DOI: 10.7270/Q24X57TQ
					More data for this Ligand-Target Pair
Snake venom metalloproteinase BaP1 (Bothrops asper)	BDBM50029799 (7-Methoxy-1-methyl-2,9-dihydro-1H-beta-carboline |...) Show SMILES COc1ccc2c3CCN=C(C)c3[nH]c2c1 |t:9| Show InChI InChI=1S/C13H14N2O/c1-8-13-11(5-6-14-8)10-4-3-9(16-2)7-12(10)15-13/h3-4,7,15H,5-6H2,1-2H3	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	7.04E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of snake venom BaP1 using Abz-Ala-Gly-Leu-Ala-Nba as substrate incubated for 30 mins prior to substrate addition by fluorescence spectroph...				ACS Med Chem Lett 3: 540-543 (2012) Article DOI: 10.1021/ml300068r BindingDB Entry DOI: 10.7270/Q2542PVS
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50297167 (2-[3-(2-Hydroxylethyl)phenylamino]benzamide | CHEM...) Show SMILES NC(=O)c1ccccc1Nc1cccc(CCO)c1 Show InChI InChI=1S/C15H16N2O2/c16-15(19)13-6-1-2-7-14(13)17-12-5-3-4-11(10-12)8-9-18/h1-7,10,17-18H,8-9H2,(H2,16,19)	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	7.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT1 by fluorimetric analysis				Bioorg Med Chem 17: 5900-5 (2009) Article DOI: 10.1016/j.bmc.2009.07.001 BindingDB Entry DOI: 10.7270/Q24X57TQ
					More data for this Ligand-Target Pair
Histone deacetylase 2 (Homo sapiens (Human))	BDBM50399674 (CHEMBL2178344) Show SMILES ONC(=O)c1cccc(c1)-c1cn(CCc2ccccc2)nn1 Show InChI InChI=1S/C17H16N4O2/c22-17(19-23)15-8-4-7-14(11-15)16-12-21(20-18-16)10-9-13-5-2-1-3-6-13/h1-8,11-12,23H,9-10H2,(H,19,22)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto Prefectural University of Medicine Curated by ChEMBL					Assay Description Inhibition of HDAC2 by fluorometric assay				J Med Chem 55: 9562-75 (2012) Article DOI: 10.1021/jm300837y BindingDB Entry DOI: 10.7270/Q25X2B3Q
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50297168 (2-Phenylsulfanylbenzamide | CHEMBL551610) Show SMILES NC(=O)c1ccccc1Sc1ccccc1 Show InChI InChI=1S/C13H11NOS/c14-13(15)11-8-4-5-9-12(11)16-10-6-2-1-3-7-10/h1-9H,(H2,14,15)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	7.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT1 by fluorimetric analysis				Bioorg Med Chem 17: 5900-5 (2009) Article DOI: 10.1016/j.bmc.2009.07.001 BindingDB Entry DOI: 10.7270/Q24X57TQ
					More data for this Ligand-Target Pair
Snake venom metalloproteinase BaP1 (Bothrops asper)	BDBM50420350 (Actin-N | Furacilin | Furacin | Furazone | NITROFU...) Show SMILES NC(=O)NN=Cc1ccc(o1)[N+]([O-])=O |w:5.5| Show InChI InChI=1S/C6H6N4O4/c7-6(11)9-8-3-4-1-2-5(14-4)10(12)13/h1-3H,(H3,7,9,11)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	8.81E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of snake venom BaP1 using Abz-Ala-Gly-Leu-Ala-Nba as substrate incubated for 30 mins prior to substrate addition by fluorescence spectroph...				ACS Med Chem Lett 3: 540-543 (2012) Article DOI: 10.1021/ml300068r BindingDB Entry DOI: 10.7270/Q2542PVS
					More data for this Ligand-Target Pair
NAD-dependent protein deacetylase sirtuin-1 (Homo sapiens (Human))	BDBM50297162 (2-(3-Phenylsulfanylphenylamino)benzamide | CHEMBL5...) Show SMILES NC(=O)c1ccccc1Nc1cccc(Sc2ccccc2)c1 Show InChI InChI=1S/C19H16N2OS/c20-19(22)17-11-4-5-12-18(17)21-14-7-6-10-16(13-14)23-15-8-2-1-3-9-15/h1-13,21H,(H2,20,22)	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	8.90E+4	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description Inhibition of human recombinant SIRT1 by fluorimetric analysis				Bioorg Med Chem 17: 5900-5 (2009) Article DOI: 10.1016/j.bmc.2009.07.001 BindingDB Entry DOI: 10.7270/Q24X57TQ
					More data for this Ligand-Target Pair
Snake venom metalloproteinase BaP1 (Bothrops asper)	BDBM50292332 (2,3,9,10-Tetramethoxy-5,6-dihydro-isoquino[3,2-a]i...) Show SMILES COc1cc2CC[n+]3cc4c(OC)c(OC)ccc4cc3-c2cc1OC Show InChI InChI=1S/C21H22NO4/c1-23-18-6-5-13-9-17-15-11-20(25-3)19(24-2)10-14(15)7-8-22(17)12-16(13)21(18)26-4/h5-6,9-12H,7-8H2,1-4H3/q+1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.33E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of snake venom BaP1 using Abz-Ala-Gly-Leu-Ala-Nba as substrate incubated for 30 mins prior to substrate addition by fluorescence spectroph...				ACS Med Chem Lett 3: 540-543 (2012) Article DOI: 10.1021/ml300068r BindingDB Entry DOI: 10.7270/Q2542PVS
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50397360 (CHEMBL2170177 | US10188756, Compound CN110) Show SMILES COc1ccc(Cn2ccc3ccc(cc23)C(=O)NO)cc1 Show InChI InChI=1S/C17H16N2O3/c1-22-15-6-2-12(3-7-15)11-19-9-8-13-4-5-14(10-16(13)19)17(20)18-21/h2-10,21H,11H2,1H3,(H,18,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto Prefectural University of Medicine Curated by ChEMBL					Assay Description Inhibition of HDAC1 by fluorometric assay				J Med Chem 55: 9562-75 (2012) Article DOI: 10.1021/jm300837y BindingDB Entry DOI: 10.7270/Q25X2B3Q
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50399674 (CHEMBL2178344) Show SMILES ONC(=O)c1cccc(c1)-c1cn(CCc2ccccc2)nn1 Show InChI InChI=1S/C17H16N4O2/c22-17(19-23)15-8-4-7-14(11-15)16-12-21(20-18-16)10-9-13-5-2-1-3-6-13/h1-8,11-12,23H,9-10H2,(H,19,22)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto Prefectural University of Medicine Curated by ChEMBL					Assay Description Inhibition of HDAC1 by fluorometric assay				J Med Chem 55: 9562-75 (2012) Article DOI: 10.1021/jm300837y BindingDB Entry DOI: 10.7270/Q25X2B3Q
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50399673 (CHEMBL2178343) Show SMILES ONC(=O)c1cccc(c1)-c1cn(CCc2ccsc2)nn1 Show InChI InChI=1S/C15H14N4O2S/c20-15(17-21)13-3-1-2-12(8-13)14-9-19(18-16-14)6-4-11-5-7-22-10-11/h1-3,5,7-10,21H,4,6H2,(H,17,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto Prefectural University of Medicine Curated by ChEMBL					Assay Description Inhibition of HDAC1 by fluorometric assay				J Med Chem 55: 9562-75 (2012) Article DOI: 10.1021/jm300837y BindingDB Entry DOI: 10.7270/Q25X2B3Q
					More data for this Ligand-Target Pair
Histone deacetylase 2 (Homo sapiens (Human))	BDBM50397360 (CHEMBL2170177 | US10188756, Compound CN110) Show SMILES COc1ccc(Cn2ccc3ccc(cc23)C(=O)NO)cc1 Show InChI InChI=1S/C17H16N2O3/c1-22-15-6-2-12(3-7-15)11-19-9-8-13-4-5-14(10-16(13)19)17(20)18-21/h2-10,21H,11H2,1H3,(H,18,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto Prefectural University of Medicine Curated by ChEMBL					Assay Description Inhibition of HDAC2 by fluorometric assay				J Med Chem 55: 9562-75 (2012) Article DOI: 10.1021/jm300837y BindingDB Entry DOI: 10.7270/Q25X2B3Q
					More data for this Ligand-Target Pair
Histone deacetylase 2 (Homo sapiens (Human))	BDBM50399673 (CHEMBL2178343) Show SMILES ONC(=O)c1cccc(c1)-c1cn(CCc2ccsc2)nn1 Show InChI InChI=1S/C15H14N4O2S/c20-15(17-21)13-3-1-2-12(8-13)14-9-19(18-16-14)6-4-11-5-7-22-10-11/h1-3,5,7-10,21H,4,6H2,(H,17,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Kyoto Prefectural University of Medicine Curated by ChEMBL					Assay Description Inhibition of HDAC2 by fluorometric assay				J Med Chem 55: 9562-75 (2012) Article DOI: 10.1021/jm300837y BindingDB Entry DOI: 10.7270/Q25X2B3Q
					More data for this Ligand-Target Pair

Displayed 1 to 50 (of 60 total )  |  Next  |  Last  >>

Jump to: