Compile Data Set for Download or QSAR

Found 45 hits with Last Name = 'kohda' and Initial = 'k'   

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
Methylated-DNA--protein-cysteine methyltransferase (Homo sapiens (Human))	BDBM50062823 (6-(4-Fluoro-benzyloxy)-5-nitroso-pyrimidine-2,4-di...) Show SMILES Nc1nc(N)c(N=O)c(OCc2ccc(F)cc2)n1 Show InChI InChI=1S/C11H10FN5O2/c12-7-3-1-6(2-4-7)5-19-10-8(17-18)9(13)15-11(14)16-10/h1-4H,5H2,(H4,13,14,15,16)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	51	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against human O6-alkylguanine-DNA alkyltransferase (AGAT)				J Med Chem 41: 503-8 (1998) Article DOI: 10.1021/jm970363i BindingDB Entry DOI: 10.7270/Q21G0KD5
					More data for this Ligand-Target Pair
Histone deacetylase (Homo sapiens (Human))	BDBM50223653 (CHEMBL332246) Show SMILES SCCCCCCC(=O)Nc1cccnc1 Show InChI InChI=1S/C12H18N2OS/c15-12(7-3-1-2-4-9-16)14-11-6-5-8-13-10-11/h5-6,8,10,16H,1-4,7,9H2,(H,14,15)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	110	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against human histone deacetylase (HDAC) using HeLa nuclear extract				Bioorg Med Chem Lett 14: 3313-7 (2004) BindingDB Entry DOI: 10.7270/Q28054SZ
					More data for this Ligand-Target Pair
Methylated-DNA--protein-cysteine methyltransferase (Homo sapiens (Human))	BDBM5573 (6-(benzyloxy)-5-nitrosopyrimidine-2,4-diamine | CH...) Show SMILES Nc1nc(N)c(N=O)c(OCc2ccccc2)n1 Show InChI InChI=1S/C11H11N5O2/c12-9-8(16-17)10(15-11(13)14-9)18-6-7-4-2-1-3-5-7/h1-5H,6H2,(H4,12,13,14,15)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	130	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against human O6-alkylguanine-DNA alkyltransferase (AGAT)				J Med Chem 41: 503-8 (1998) Article DOI: 10.1021/jm970363i BindingDB Entry DOI: 10.7270/Q21G0KD5
					More data for this Ligand-Target Pair
Histone deacetylase (Homo sapiens (Human))	BDBM19131 (CHEMBL419758 | JMC505425 Compound 7 | N-(4-phenyl-...) Show SMILES SCCCCCCC(=O)Nc1nc(cs1)-c1ccccc1 Show InChI InChI=1S/C16H20N2OS2/c19-15(10-6-1-2-7-11-20)18-16-17-14(12-21-16)13-8-4-3-5-9-13/h3-5,8-9,12,20H,1-2,6-7,10-11H2,(H,17,18,19)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	170	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against human histone deacetylase (HDAC) using HeLa nuclear extract				Bioorg Med Chem Lett 14: 3313-7 (2004) BindingDB Entry DOI: 10.7270/Q28054SZ
					More data for this Ligand-Target Pair
Histone deacetylase (Homo sapiens (Human))	BDBM152692 (Thiol-SAHA (t-SAHA)) Show SMILES SCCCCCCC(=O)Nc1ccccc1 Show InChI InChI=1S/C13H19NOS/c15-13(10-6-1-2-7-11-16)14-12-8-4-3-5-9-12/h3-5,8-9,16H,1-2,6-7,10-11H2,(H,14,15)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PubMed	n/a	n/a	210	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against human histone deacetylase (HDAC) using HeLa nuclear extract				Bioorg Med Chem Lett 14: 3313-7 (2004) BindingDB Entry DOI: 10.7270/Q28054SZ
					More data for this Ligand-Target Pair
Histone deacetylase (Homo sapiens (Human))	BDBM50223648 (CHEMBL322504) Show SMILES SCCCCCCC(=O)Nc1cccc(Oc2ccccc2)c1 Show InChI InChI=1S/C19H23NO2S/c21-19(13-6-1-2-7-14-23)20-16-9-8-12-18(15-16)22-17-10-4-3-5-11-17/h3-5,8-12,15,23H,1-2,6-7,13-14H2,(H,20,21)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	210	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against human histone deacetylase (HDAC) using HeLa nuclear extract				Bioorg Med Chem Lett 14: 3313-7 (2004) BindingDB Entry DOI: 10.7270/Q28054SZ
					More data for this Ligand-Target Pair
Methylated-DNA--protein-cysteine methyltransferase (Homo sapiens (Human))	BDBM50062816 (5-Nitroso-6-(pyridin-4-ylmethoxy)-pyrimidine-2,4-d...) Show SMILES Nc1nc(N)c(N=O)c(OCc2ccncc2)n1 Show InChI InChI=1S/C10H10N6O2/c11-8-7(16-17)9(15-10(12)14-8)18-5-6-1-3-13-4-2-6/h1-4H,5H2,(H4,11,12,14,15)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	230	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against human O6-alkylguanine-DNA alkyltransferase (AGAT)				J Med Chem 41: 503-8 (1998) Article DOI: 10.1021/jm970363i BindingDB Entry DOI: 10.7270/Q21G0KD5
					More data for this Ligand-Target Pair
Histone deacetylase (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 KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	PDB PubMed	n/a	n/a	280	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against histone deacetylase (HDAC) isolated from HeLa nuclear extract				Bioorg Med Chem Lett 13: 4321-6 (2003) BindingDB Entry DOI: 10.7270/Q2Q81G8N
					More data for this Ligand-Target Pair				3D Structure (crystal)
Methylated-DNA--protein-cysteine methyltransferase (Homo sapiens (Human))	BDBM50062815 (6-(4-Fluoro-benzyloxy)-5-nitro-pyrimidine-2,4-diam...) Show SMILES Nc1nc(N)c(c(OCc2ccc(F)cc2)n1)[N+]([O-])=O Show InChI InChI=1S/C11H10FN5O3/c12-7-3-1-6(2-4-7)5-20-10-8(17(18)19)9(13)15-11(14)16-10/h1-4H,5H2,(H4,13,14,15,16)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	350	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against human O6-alkylguanine-DNA alkyltransferase (AGAT)				J Med Chem 41: 503-8 (1998) Article DOI: 10.1021/jm970363i BindingDB Entry DOI: 10.7270/Q21G0KD5
					More data for this Ligand-Target Pair
Histone deacetylase (Homo sapiens (Human))	BDBM50223650 (CHEMBL112364) Show SMILES SCCCCCCNC(=O)c1ccccc1 Show InChI InChI=1S/C13H19NOS/c15-13(12-8-4-3-5-9-12)14-10-6-1-2-7-11-16/h3-5,8-9,16H,1-2,6-7,10-11H2,(H,14,15)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	360	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against human histone deacetylase (HDAC) using HeLa nuclear extract				Bioorg Med Chem Lett 14: 3313-7 (2004) BindingDB Entry DOI: 10.7270/Q28054SZ
					More data for this Ligand-Target Pair
Histone deacetylase (Homo sapiens (Human))	BDBM50223651 (CHEMBL112129) Show SMILES SCCCCCCC(=O)Nc1ccc(Oc2ccccc2)cc1 Show InChI InChI=1S/C19H23NO2S/c21-19(10-6-1-2-7-15-23)20-16-11-13-18(14-12-16)22-17-8-4-3-5-9-17/h3-5,8-9,11-14,23H,1-2,6-7,10,15H2,(H,20,21)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	620	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against human histone deacetylase (HDAC) using HeLa nuclear extract				Bioorg Med Chem Lett 14: 3313-7 (2004) BindingDB Entry DOI: 10.7270/Q28054SZ
					More data for this Ligand-Target Pair
Methylated-DNA--protein-cysteine methyltransferase (Homo sapiens (Human))	BDBM50062813 (6-Benzyloxy-5-nitro-pyrimidine-2,4-diamine | CHEMB...) Show SMILES Nc1nc(N)c(c(OCc2ccccc2)n1)[N+]([O-])=O Show InChI InChI=1S/C11H11N5O3/c12-9-8(16(17)18)10(15-11(13)14-9)19-6-7-4-2-1-3-5-7/h1-5H,6H2,(H4,12,13,14,15)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against human O6-alkylguanine-DNA alkyltransferase (AGAT)				J Med Chem 41: 503-8 (1998) Article DOI: 10.1021/jm970363i BindingDB Entry DOI: 10.7270/Q21G0KD5
					More data for this Ligand-Target Pair
Methylated-DNA--protein-cysteine methyltransferase (Homo sapiens (Human))	BDBM50062819 (5-Nitro-6-(pyridin-3-ylmethoxy)-pyrimidine-2,4-dia...) Show SMILES Nc1nc(N)c(c(OCc2cccnc2)n1)[N+]([O-])=O Show InChI InChI=1S/C10H10N6O3/c11-8-7(16(17)18)9(15-10(12)14-8)19-5-6-2-1-3-13-4-6/h1-4H,5H2,(H4,11,12,14,15)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against human O6-alkylguanine-DNA alkyltransferase (AGAT)				J Med Chem 41: 503-8 (1998) Article DOI: 10.1021/jm970363i BindingDB Entry DOI: 10.7270/Q21G0KD5
					More data for this Ligand-Target Pair
Methylated-DNA--protein-cysteine methyltransferase (Homo sapiens (Human))	BDBM50062818 (5-Nitro-6-(pyridin-4-ylmethoxy)-pyrimidine-2,4-dia...) Show SMILES Nc1nc(N)c(c(OCc2ccncc2)n1)[N+]([O-])=O Show InChI InChI=1S/C10H10N6O3/c11-8-7(16(17)18)9(15-10(12)14-8)19-5-6-1-3-13-4-2-6/h1-4H,5H2,(H4,11,12,14,15)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against human O6-alkylguanine-DNA alkyltransferase (AGAT)				J Med Chem 41: 503-8 (1998) Article DOI: 10.1021/jm970363i BindingDB Entry DOI: 10.7270/Q21G0KD5
					More data for this Ligand-Target Pair
Methylated-DNA--protein-cysteine methyltransferase (Homo sapiens (Human))	BDBM50062817 (6-(3-Fluoro-benzyloxy)-5-nitro-pyrimidine-2,4-diam...) Show SMILES Nc1nc(N)c(c(OCc2cccc(F)c2)n1)[N+]([O-])=O Show InChI InChI=1S/C11H10FN5O3/c12-7-3-1-2-6(4-7)5-20-10-8(17(18)19)9(13)15-11(14)16-10/h1-4H,5H2,(H4,13,14,15,16)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against human O6-alkylguanine-DNA alkyltransferase (AGAT)				J Med Chem 41: 503-8 (1998) Article DOI: 10.1021/jm970363i BindingDB Entry DOI: 10.7270/Q21G0KD5
					More data for this Ligand-Target Pair
Methylated-DNA--protein-cysteine methyltransferase (Homo sapiens (Human))	BDBM5491 (6-(benzyloxy)-9H-purin-2-amine | CHEMBL407874 | O6...) Show SMILES Nc1nc(OCc2ccccc2)c2[nH]cnc2n1 Show InChI InChI=1S/C12H11N5O/c13-12-16-10-9(14-7-15-10)11(17-12)18-6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H3,13,14,15,16,17)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE MMDB PC cid PC sid PDB UniChem Patents Similars	MMDB PDB Article PubMed	n/a	n/a	2.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against human O6-alkylguanine-DNA alkyltransferase (AGAT)				J Med Chem 41: 503-8 (1998) Article DOI: 10.1021/jm970363i BindingDB Entry DOI: 10.7270/Q21G0KD5
					More data for this Ligand-Target Pair				3D Structure (crystal)
Histone deacetylase (Homo sapiens (Human))	BDBM50121062 (9,9,9-TRIFLUORO-8-OXO-N-PHENYLNONANAMIDE | 9,9,9-T...) Show SMILES FC(F)(F)C(=O)CCCCCCC(=O)Nc1ccccc1 Show InChI InChI=1S/C15H18F3NO2/c16-15(17,18)13(20)10-6-1-2-7-11-14(21)19-12-8-4-3-5-9-12/h3-5,8-9H,1-2,6-7,10-11H2,(H,19,21)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL DrugBank MMDB PC cid PC sid PDB UniChem Patents	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 In vitro inhibitory activity against human histone deacetylase (HDAC) using HeLa nuclear extract				Bioorg Med Chem Lett 14: 3313-7 (2004) BindingDB Entry DOI: 10.7270/Q28054SZ
					More data for this Ligand-Target Pair
Histone deacetylase (Homo sapiens (Human))	BDBM50223652 (CHEMBL109796) Show SMILES SCCCCCCOc1ccccc1 Show InChI InChI=1S/C12H18OS/c14-11-7-2-1-6-10-13-12-8-4-3-5-9-12/h3-5,8-9,14H,1-2,6-7,10-11H2	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents	PubMed	n/a	n/a	1.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against human histone deacetylase (HDAC) using HeLa nuclear extract				Bioorg Med Chem Lett 14: 3313-7 (2004) BindingDB Entry DOI: 10.7270/Q28054SZ
					More data for this Ligand-Target Pair
Methylated-DNA--protein-cysteine methyltransferase (Homo sapiens (Human))	BDBM50062822 (6-(2-Fluoro-benzyloxy)-5-nitro-pyrimidine-2,4-diam...) Show SMILES Nc1nc(N)c(c(OCc2ccccc2F)n1)[N+]([O-])=O Show InChI InChI=1S/C11H10FN5O3/c12-7-4-2-1-3-6(7)5-20-10-8(17(18)19)9(13)15-11(14)16-10/h1-4H,5H2,(H4,13,14,15,16)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against human O6-alkylguanine-DNA alkyltransferase (AGAT)				J Med Chem 41: 503-8 (1998) Article DOI: 10.1021/jm970363i BindingDB Entry DOI: 10.7270/Q21G0KD5
					More data for this Ligand-Target Pair
Histone deacetylase (Homo sapiens (Human))	BDBM50222441 (CHEMBL114237) Show SMILES BrCC(=O)NCCCCCCC(=O)Nc1ccccc1 Show InChI InChI=1S/C15H21BrN2O2/c16-12-15(20)17-11-7-2-1-6-10-14(19)18-13-8-4-3-5-9-13/h3-5,8-9H,1-2,6-7,10-12H2,(H,17,20)(H,18,19)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	1.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against histone deacetylase (HDAC) isolated from HeLa nuclear extract				Bioorg Med Chem Lett 13: 4321-6 (2003) BindingDB Entry DOI: 10.7270/Q2Q81G8N
					More data for this Ligand-Target Pair
Histone deacetylase (Homo sapiens (Human))	BDBM50222416 (CHEMBL344920) Show SMILES BrCC(=O)NCCCCCC(=O)Nc1ccccc1 Show InChI InChI=1S/C14H19BrN2O2/c15-11-14(19)16-10-6-2-5-9-13(18)17-12-7-3-1-4-8-12/h1,3-4,7-8H,2,5-6,9-11H2,(H,16,19)(H,17,18)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.70E+4	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against histone deacetylase (HDAC) isolated from HeLa nuclear extract				Bioorg Med Chem Lett 13: 4321-6 (2003) BindingDB Entry DOI: 10.7270/Q2Q81G8N
					More data for this Ligand-Target Pair
Methylated-DNA--protein-cysteine methyltransferase (Homo sapiens (Human))	BDBM50062814 (5-Nitro-6-(pyridin-2-ylmethoxy)-pyrimidine-2,4-dia...) Show SMILES Nc1nc(N)c(c(OCc2ccccn2)n1)[N+]([O-])=O Show InChI InChI=1S/C10H10N6O3/c11-8-7(16(17)18)9(15-10(12)14-8)19-5-6-3-1-2-4-13-6/h1-4H,5H2,(H4,11,12,14,15)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against human O6-alkylguanine-DNA alkyltransferase (AGAT)				J Med Chem 41: 503-8 (1998) Article DOI: 10.1021/jm970363i BindingDB Entry DOI: 10.7270/Q21G0KD5
					More data for this Ligand-Target Pair
Histone deacetylase (Homo sapiens (Human))	BDBM50222409 (CHEMBL137333) Show SMILES OCCNC(=O)CCCCCCC(=O)Nc1ccccc1 Show InChI InChI=1S/C16H24N2O3/c19-13-12-17-15(20)10-6-1-2-7-11-16(21)18-14-8-4-3-5-9-14/h3-5,8-9,19H,1-2,6-7,10-13H2,(H,17,20)(H,18,21)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against histone deacetylase (HDAC) isolated from HeLa nuclear extract				Bioorg Med Chem Lett 13: 4321-6 (2003) BindingDB Entry DOI: 10.7270/Q2Q81G8N
					More data for this Ligand-Target Pair
Histone deacetylase (Homo sapiens (Human))	BDBM50222415 (CHEMBL136992) Show SMILES CCOC(=O)NCCCCCCC(=O)Nc1ccccc1 Show InChI InChI=1S/C16H24N2O3/c1-2-21-16(20)17-13-9-4-3-8-12-15(19)18-14-10-6-5-7-11-14/h5-7,10-11H,2-4,8-9,12-13H2,1H3,(H,17,20)(H,18,19)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against histone deacetylase (HDAC) isolated from HeLa nuclear extract				Bioorg Med Chem Lett 13: 4321-6 (2003) BindingDB Entry DOI: 10.7270/Q2Q81G8N
					More data for this Ligand-Target Pair
Histone deacetylase (Homo sapiens (Human))	BDBM50222442 (CHEMBL423356) Show SMILES OCCOC(=O)CCCCCCC(=O)Nc1ccccc1 Show InChI InChI=1S/C16H23NO4/c18-12-13-21-16(20)11-7-2-1-6-10-15(19)17-14-8-4-3-5-9-14/h3-5,8-9,18H,1-2,6-7,10-13H2,(H,17,19)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against histone deacetylase (HDAC) isolated from HeLa nuclear extract				Bioorg Med Chem Lett 13: 4321-6 (2003) BindingDB Entry DOI: 10.7270/Q2Q81G8N
					More data for this Ligand-Target Pair
Histone deacetylase (Homo sapiens (Human))	BDBM50222443 (CHEMBL264784) Show SMILES O=C(CCCCCCN(CC#C)CC#C)Nc1ccccc1 Show InChI InChI=1S/C19H24N2O/c1-3-15-21(16-4-2)17-11-6-5-10-14-19(22)20-18-12-8-7-9-13-18/h1-2,7-9,12-13H,5-6,10-11,14-17H2,(H,20,22)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against histone deacetylase (HDAC) isolated from HeLa nuclear extract				Bioorg Med Chem Lett 13: 4321-6 (2003) BindingDB Entry DOI: 10.7270/Q2Q81G8N
					More data for this Ligand-Target Pair
Histone deacetylase (Homo sapiens (Human))	BDBM50222444 (CHEMBL137036) Show SMILES ClC(Cl)(Cl)C(=O)NCCCCCCC(=O)Nc1ccccc1 Show InChI InChI=1S/C15H19Cl3N2O2/c16-15(17,18)14(22)19-11-7-2-1-6-10-13(21)20-12-8-4-3-5-9-12/h3-5,8-9H,1-2,6-7,10-11H2,(H,19,22)(H,20,21)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against histone deacetylase (HDAC) isolated from HeLa nuclear extract				Bioorg Med Chem Lett 13: 4321-6 (2003) BindingDB Entry DOI: 10.7270/Q2Q81G8N
					More data for this Ligand-Target Pair
Histone deacetylase (Homo sapiens (Human))	BDBM50222454 (CHEMBL137003) Show SMILES FC(F)(F)C(=O)NCCCCCCC(=O)Nc1ccccc1 Show InChI InChI=1S/C15H19F3N2O2/c16-15(17,18)14(22)19-11-7-2-1-6-10-13(21)20-12-8-4-3-5-9-12/h3-5,8-9H,1-2,6-7,10-11H2,(H,19,22)(H,20,21)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against histone deacetylase (HDAC) isolated from HeLa nuclear extract				Bioorg Med Chem Lett 13: 4321-6 (2003) BindingDB Entry DOI: 10.7270/Q2Q81G8N
					More data for this Ligand-Target Pair
Histone deacetylase (Homo sapiens (Human))	BDBM50222446 (CHEMBL137672) Show SMILES O\N=C(\CCCCCCC(=O)Nc1ccccc1)c1ccccn1 Show InChI InChI=1S/C19H23N3O2/c23-19(21-16-10-4-3-5-11-16)14-7-2-1-6-13-18(22-24)17-12-8-9-15-20-17/h3-5,8-12,15,24H,1-2,6-7,13-14H2,(H,21,23)/b22-18-	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against histone deacetylase (HDAC) isolated from HeLa nuclear extract				Bioorg Med Chem Lett 13: 4321-6 (2003) BindingDB Entry DOI: 10.7270/Q2Q81G8N
					More data for this Ligand-Target Pair
Histone deacetylase (Homo sapiens (Human))	BDBM50222453 (CHEMBL137695) Show SMILES O=C(CCCCCCC(=O)c1ccccn1)Nc1ccccc1 Show InChI InChI=1S/C19H22N2O2/c22-18(17-12-8-9-15-20-17)13-6-1-2-7-14-19(23)21-16-10-4-3-5-11-16/h3-5,8-12,15H,1-2,6-7,13-14H2,(H,21,23)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against histone deacetylase (HDAC) isolated from HeLa nuclear extract				Bioorg Med Chem Lett 13: 4321-6 (2003) BindingDB Entry DOI: 10.7270/Q2Q81G8N
					More data for this Ligand-Target Pair
Histone deacetylase (Homo sapiens (Human))	BDBM50222448 (CHEMBL137278) Show SMILES COC(=O)NCCCCCCC(=O)Nc1ccccc1 Show InChI InChI=1S/C15H22N2O3/c1-20-15(19)16-12-8-3-2-7-11-14(18)17-13-9-5-4-6-10-13/h4-6,9-10H,2-3,7-8,11-12H2,1H3,(H,16,19)(H,17,18)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against histone deacetylase (HDAC) isolated from HeLa nuclear extract				Bioorg Med Chem Lett 13: 4321-6 (2003) BindingDB Entry DOI: 10.7270/Q2Q81G8N
					More data for this Ligand-Target Pair
Histone deacetylase (Homo sapiens (Human))	BDBM50222449 (CHEMBL344475) Show SMILES NCCNC(=O)CCCCCCC(=O)Nc1ccccc1 Show InChI InChI=1S/C16H25N3O2/c17-12-13-18-15(20)10-6-1-2-7-11-16(21)19-14-8-4-3-5-9-14/h3-5,8-9H,1-2,6-7,10-13,17H2,(H,18,20)(H,19,21)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against histone deacetylase (HDAC) isolated from HeLa nuclear extract				Bioorg Med Chem Lett 13: 4321-6 (2003) BindingDB Entry DOI: 10.7270/Q2Q81G8N
					More data for this Ligand-Target Pair
Histone deacetylase (Homo sapiens (Human))	BDBM50222412 (CHEMBL341701) Show SMILES O=C(CCCCCCNCC#C)Nc1ccccc1 Show InChI InChI=1S/C16H22N2O/c1-2-13-17-14-9-4-3-8-12-16(19)18-15-10-6-5-7-11-15/h1,5-7,10-11,17H,3-4,8-9,12-14H2,(H,18,19)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against histone deacetylase (HDAC) isolated from HeLa nuclear extract				Bioorg Med Chem Lett 13: 4321-6 (2003) BindingDB Entry DOI: 10.7270/Q2Q81G8N
					More data for this Ligand-Target Pair
Histone deacetylase (Homo sapiens (Human))	BDBM50223649 (7-Methylsulfanyl-Heptanoic Acid Phenylamide | CHEM...) Show SMILES CSCCCCCCC(=O)Nc1ccccc1 Show InChI InChI=1S/C14H21NOS/c1-17-12-8-3-2-7-11-14(16)15-13-9-5-4-6-10-13/h4-6,9-10H,2-3,7-8,11-12H2,1H3,(H,15,16)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against human histone deacetylase (HDAC) using HeLa nuclear extract				Bioorg Med Chem Lett 14: 3313-7 (2004) BindingDB Entry DOI: 10.7270/Q28054SZ
					More data for this Ligand-Target Pair
Histone deacetylase (Homo sapiens (Human))	BDBM50222452 (CHEMBL137100 | Octanedioic acid phenylamide pyridi...) Show SMILES O=C(CCCCCCC(=O)Nc1ccccn1)Nc1ccccc1 Show InChI InChI=1S/C19H23N3O2/c23-18(21-16-10-4-3-5-11-16)13-6-1-2-7-14-19(24)22-17-12-8-9-15-20-17/h3-5,8-12,15H,1-2,6-7,13-14H2,(H,21,23)(H,20,22,24)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against histone deacetylase (HDAC) isolated from HeLa nuclear extract				Bioorg Med Chem Lett 13: 4321-6 (2003) BindingDB Entry DOI: 10.7270/Q2Q81G8N
					More data for this Ligand-Target Pair
Histone deacetylase (Homo sapiens (Human))	BDBM50222451 (CHEMBL343377 | Octanedioic acid phenylamide thiazo...) Show SMILES O=C(CCCCCCC(=O)Nc1ccccc1)Nc1nccs1 Show InChI InChI=1S/C17H21N3O2S/c21-15(19-14-8-4-3-5-9-14)10-6-1-2-7-11-16(22)20-17-18-12-13-23-17/h3-5,8-9,12-13H,1-2,6-7,10-11H2,(H,19,21)(H,18,20,22)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against histone deacetylase (HDAC) isolated from HeLa nuclear extract				Bioorg Med Chem Lett 13: 4321-6 (2003) BindingDB Entry DOI: 10.7270/Q2Q81G8N
					More data for this Ligand-Target Pair
Histone deacetylase (Homo sapiens (Human))	BDBM50222410 (7-Ureido-Heptanoic Acid Phenylamide | CHEMBL137216) Show SMILES NC(=O)NCCCCCCC(=O)Nc1ccccc1 Show InChI InChI=1S/C14H21N3O2/c15-14(19)16-11-7-2-1-6-10-13(18)17-12-8-4-3-5-9-12/h3-5,8-9H,1-2,6-7,10-11H2,(H,17,18)(H3,15,16,19)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against histone deacetylase (HDAC) isolated from HeLa nuclear extract				Bioorg Med Chem Lett 13: 4321-6 (2003) BindingDB Entry DOI: 10.7270/Q2Q81G8N
					More data for this Ligand-Target Pair
Histone deacetylase (Homo sapiens (Human))	BDBM50222414 (BML-210 | CHEBI:61077 | CHEMBL324053) Show SMILES Nc1ccccc1NC(=O)CCCCCCC(=O)Nc1ccccc1 Show InChI InChI=1S/C20H25N3O2/c21-17-12-8-9-13-18(17)23-20(25)15-7-2-1-6-14-19(24)22-16-10-4-3-5-11-16/h3-5,8-13H,1-2,6-7,14-15,21H2,(H,22,24)(H,23,25)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.20E+5	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against histone deacetylase (HDAC) isolated from HeLa nuclear extract				Bioorg Med Chem Lett 13: 4321-6 (2003) BindingDB Entry DOI: 10.7270/Q2Q81G8N
					More data for this Ligand-Target Pair
Histone deacetylase (Homo sapiens (Human))	BDBM50222414 (BML-210 | CHEBI:61077 | CHEMBL324053) Show SMILES Nc1ccccc1NC(=O)CCCCCCC(=O)Nc1ccccc1 Show InChI InChI=1S/C20H25N3O2/c21-17-12-8-9-13-18(17)23-20(25)15-7-2-1-6-14-19(24)22-16-10-4-3-5-11-16/h3-5,8-13H,1-2,6-7,14-15,21H2,(H,22,24)(H,23,25)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.20E+5	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against human histone deacetylase (HDAC) using HeLa nuclear extract				Bioorg Med Chem Lett 14: 3313-7 (2004) BindingDB Entry DOI: 10.7270/Q28054SZ
					More data for this Ligand-Target Pair
Histone deacetylase (Homo sapiens (Human))	BDBM50222447 (CHEMBL138381) Show SMILES BrCC(=O)NCCCCC(=O)Nc1ccccc1 Show InChI InChI=1S/C13H17BrN2O2/c14-10-13(18)15-9-5-4-8-12(17)16-11-6-2-1-3-7-11/h1-3,6-7H,4-5,8-10H2,(H,15,18)(H,16,17)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.21E+5	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against histone deacetylase (HDAC) isolated from HeLa nuclear extract				Bioorg Med Chem Lett 13: 4321-6 (2003) BindingDB Entry DOI: 10.7270/Q2Q81G8N
					More data for this Ligand-Target Pair
Histone deacetylase (Homo sapiens (Human))	BDBM50222413 (CHEMBL112539) Show SMILES NNC(=O)NCCCCCC(=O)Nc1ccccc1 Show InChI InChI=1S/C13H20N4O2/c14-17-13(19)15-10-6-2-5-9-12(18)16-11-7-3-1-4-8-11/h1,3-4,7-8H,2,5-6,9-10,14H2,(H,16,18)(H2,15,17,19)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against histone deacetylase (HDAC) isolated from HeLa nuclear extract				Bioorg Med Chem Lett 13: 4321-6 (2003) BindingDB Entry DOI: 10.7270/Q2Q81G8N
					More data for this Ligand-Target Pair
Methylated-DNA--protein-cysteine methyltransferase (Homo sapiens (Human))	BDBM50062821 (6-Benzyloxy-pyrimidine-2,4-diamine | CHEMBL121445) Show SMILES Nc1cc(OCc2ccccc2)nc(N)n1 Show InChI InChI=1S/C11H12N4O/c12-9-6-10(15-11(13)14-9)16-7-8-4-2-1-3-5-8/h1-6H,7H2,(H4,12,13,14,15)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	1.70E+5	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against human O6-alkylguanine-DNA alkyltransferase (AGAT)				J Med Chem 41: 503-8 (1998) Article DOI: 10.1021/jm970363i BindingDB Entry DOI: 10.7270/Q21G0KD5
					More data for this Ligand-Target Pair
Histone deacetylase (Homo sapiens (Human))	BDBM50222450 (CHEMBL137519) Show SMILES BrCC(=O)NCCCCCCCC(=O)Nc1ccccc1 Show InChI InChI=1S/C16H23BrN2O2/c17-13-16(21)18-12-8-3-1-2-7-11-15(20)19-14-9-5-4-6-10-14/h4-6,9-10H,1-3,7-8,11-13H2,(H,18,21)(H,19,20)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	3.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against histone deacetylase (HDAC) isolated from HeLa nuclear extract				Bioorg Med Chem Lett 13: 4321-6 (2003) BindingDB Entry DOI: 10.7270/Q2Q81G8N
					More data for this Ligand-Target Pair
Histone deacetylase (Homo sapiens (Human))	BDBM50222445 (CHEMBL422460) Show SMILES NNC(=O)NCCCCCCC(=O)Nc1ccccc1 Show InChI InChI=1S/C14H22N4O2/c15-18-14(20)16-11-7-2-1-6-10-13(19)17-12-8-4-3-5-9-12/h3-5,8-9H,1-2,6-7,10-11,15H2,(H,17,19)(H2,16,18,20)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	6.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against histone deacetylase (HDAC) isolated from HeLa nuclear extract				Bioorg Med Chem Lett 13: 4321-6 (2003) BindingDB Entry DOI: 10.7270/Q2Q81G8N
					More data for this Ligand-Target Pair
Histone deacetylase (Homo sapiens (Human))	BDBM50222411 (CHEMBL136792) Show SMILES NNC(=O)NCCCCC(=O)Nc1ccccc1 Show InChI InChI=1S/C12H18N4O2/c13-16-12(18)14-9-5-4-8-11(17)15-10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9,13H2,(H,15,17)(H2,14,16,18)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
Nagoya City University Curated by ChEMBL					Assay Description In vitro inhibitory activity against histone deacetylase (HDAC) isolated from HeLa nuclear extract				Bioorg Med Chem Lett 13: 4321-6 (2003) BindingDB Entry DOI: 10.7270/Q2Q81G8N
					More data for this Ligand-Target Pair