Compile Data Set for Download or QSAR

Found 54 hits from Guru Ghasidas University   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50354789 (CHEMBL1834469) Show SMILES ONC(=O)c1cnc(Nc2nnc(o2)-c2cccc(Cl)c2)nc1 Show InChI InChI=1S/C13H9ClN6O3/c14-9-3-1-2-7(4-9)11-18-19-13(23-11)17-12-15-5-8(6-16-12)10(21)20-22/h1-6,22H,(H,20,21)(H,15,16,17,19)	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	6	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 by fluorescent activity assay				Bioorg Med Chem Lett 21: 5735-8 (2011) Article DOI: 10.1016/j.bmcl.2011.08.022 BindingDB Entry DOI: 10.7270/Q2028RZ0
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50354781 (CHEMBL1834462) Show SMILES ONC(=O)c1cnc(Nc2nnc(o2)-c2ccccc2)nc1 Show InChI InChI=1S/C13H10N6O3/c20-10(19-21)9-6-14-12(15-7-9)16-13-18-17-11(22-13)8-4-2-1-3-5-8/h1-7,21H,(H,19,20)(H,14,15,16,18)	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	6	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 by fluorescent activity assay				Bioorg Med Chem Lett 21: 5735-8 (2011) Article DOI: 10.1016/j.bmcl.2011.08.022 BindingDB Entry DOI: 10.7270/Q2028RZ0
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50354800 (CHEMBL1834480) Show SMILES ONC(=O)c1cnc(Nc2nnc(s2)-c2cccc(Cl)c2)nc1 Show InChI InChI=1S/C13H9ClN6O2S/c14-9-3-1-2-7(4-9)11-18-19-13(23-11)17-12-15-5-8(6-16-12)10(21)20-22/h1-6,22H,(H,20,21)(H,15,16,17,19)	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	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 by fluorescent activity assay				Bioorg Med Chem Lett 21: 5735-8 (2011) Article DOI: 10.1016/j.bmcl.2011.08.022 BindingDB Entry DOI: 10.7270/Q2028RZ0
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50354797 (CHEMBL1834477) Show SMILES ONC(=O)c1cnc(Nc2nnc(s2)-c2ccc(F)cc2)nc1 Show InChI InChI=1S/C13H9FN6O2S/c14-9-3-1-7(2-4-9)11-18-19-13(23-11)17-12-15-5-8(6-16-12)10(21)20-22/h1-6,22H,(H,20,21)(H,15,16,17,19)	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	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 by fluorescent activity assay				Bioorg Med Chem Lett 21: 5735-8 (2011) Article DOI: 10.1016/j.bmcl.2011.08.022 BindingDB Entry DOI: 10.7270/Q2028RZ0
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50354799 (CHEMBL1834479) Show SMILES ONC(=O)c1cnc(Nc2nnc(s2)-c2ccccc2Cl)nc1 Show InChI InChI=1S/C13H9ClN6O2S/c14-9-4-2-1-3-8(9)11-18-19-13(23-11)17-12-15-5-7(6-16-12)10(21)20-22/h1-6,22H,(H,20,21)(H,15,16,17,19)	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	8	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 by fluorescent activity assay				Bioorg Med Chem Lett 21: 5735-8 (2011) Article DOI: 10.1016/j.bmcl.2011.08.022 BindingDB Entry DOI: 10.7270/Q2028RZ0
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50354792 (CHEMBL1834472) Show SMILES ONC(=O)c1cnc(Nc2nnc(s2)-c2ccccc2)nc1 Show InChI InChI=1S/C13H10N6O2S/c20-10(19-21)9-6-14-12(15-7-9)16-13-18-17-11(22-13)8-4-2-1-3-5-8/h1-7,21H,(H,19,20)(H,14,15,16,18)	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	8	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 by fluorescent activity assay				Bioorg Med Chem Lett 21: 5735-8 (2011) Article DOI: 10.1016/j.bmcl.2011.08.022 BindingDB Entry DOI: 10.7270/Q2028RZ0
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50354788 (CHEMBL1834468) Show SMILES ONC(=O)c1cnc(Nc2nnc(o2)-c2ccccc2Cl)nc1 Show InChI InChI=1S/C13H9ClN6O3/c14-9-4-2-1-3-8(9)11-18-19-13(23-11)17-12-15-5-7(6-16-12)10(21)20-22/h1-6,22H,(H,20,21)(H,15,16,17,19)	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	8	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 by fluorescent activity assay				Bioorg Med Chem Lett 21: 5735-8 (2011) Article DOI: 10.1016/j.bmcl.2011.08.022 BindingDB Entry DOI: 10.7270/Q2028RZ0
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50354782 (CHEMBL1834461) Show SMILES ONC(=O)c1cnc(Nc2nnc(o2)-c2ccc(Cl)cc2)nc1 Show InChI InChI=1S/C13H9ClN6O3/c14-9-3-1-7(2-4-9)11-18-19-13(23-11)17-12-15-5-8(6-16-12)10(21)20-22/h1-6,22H,(H,20,21)(H,15,16,17,19)	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	9	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 by fluorescent activity assay				Bioorg Med Chem Lett 21: 5735-8 (2011) Article DOI: 10.1016/j.bmcl.2011.08.022 BindingDB Entry DOI: 10.7270/Q2028RZ0
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50354786 (CHEMBL1834466) Show SMILES ONC(=O)c1cnc(Nc2nnc(o2)-c2ccc(F)cc2)nc1 Show InChI InChI=1S/C13H9FN6O3/c14-9-3-1-7(2-4-9)11-18-19-13(23-11)17-12-15-5-8(6-16-12)10(21)20-22/h1-6,22H,(H,20,21)(H,15,16,17,19)	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	9	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 by fluorescent activity assay				Bioorg Med Chem Lett 21: 5735-8 (2011) Article DOI: 10.1016/j.bmcl.2011.08.022 BindingDB Entry DOI: 10.7270/Q2028RZ0
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50354791 (CHEMBL1834471) Show SMILES CN(C)c1ccc(cc1)-c1nnc(Nc2ncc(cn2)C(=O)NO)o1 Show InChI InChI=1S/C15H15N7O3/c1-22(2)11-5-3-9(4-6-11)13-19-20-15(25-13)18-14-16-7-10(8-17-14)12(23)21-24/h3-8,24H,1-2H3,(H,21,23)(H,16,17,18,20)	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	9	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 by fluorescent activity assay				Bioorg Med Chem Lett 21: 5735-8 (2011) Article DOI: 10.1016/j.bmcl.2011.08.022 BindingDB Entry DOI: 10.7270/Q2028RZ0
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50354783 (CHEMBL1834463) Show SMILES ONC(=O)c1cnc(Nc2nnc(o2)-c2ccc(cc2)[N+]([O-])=O)nc1 Show InChI InChI=1S/C13H9N7O5/c21-10(19-22)8-5-14-12(15-6-8)16-13-18-17-11(25-13)7-1-3-9(4-2-7)20(23)24/h1-6,22H,(H,19,21)(H,14,15,16,18)	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	10	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 by fluorescent activity assay				Bioorg Med Chem Lett 21: 5735-8 (2011) Article DOI: 10.1016/j.bmcl.2011.08.022 BindingDB Entry DOI: 10.7270/Q2028RZ0
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50354794 (CHEMBL1834474) Show SMILES ONC(=O)c1cnc(Nc2nnc(s2)-c2ccc(cc2)[N+]([O-])=O)nc1 Show InChI InChI=1S/C13H9N7O4S/c21-10(19-22)8-5-14-12(15-6-8)16-13-18-17-11(25-13)7-1-3-9(4-2-7)20(23)24/h1-6,22H,(H,19,21)(H,14,15,16,18)	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	10	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 by fluorescent activity assay				Bioorg Med Chem Lett 21: 5735-8 (2011) Article DOI: 10.1016/j.bmcl.2011.08.022 BindingDB Entry DOI: 10.7270/Q2028RZ0
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50354793 (CHEMBL1834473) Show SMILES ONC(=O)c1cnc(Nc2nnc(s2)-c2ccc(Cl)cc2)nc1 Show InChI InChI=1S/C13H9ClN6O2S/c14-9-3-1-7(2-4-9)11-18-19-13(23-11)17-12-15-5-8(6-16-12)10(21)20-22/h1-6,22H,(H,20,21)(H,15,16,17,19)	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	10	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 by fluorescent activity assay				Bioorg Med Chem Lett 21: 5735-8 (2011) Article DOI: 10.1016/j.bmcl.2011.08.022 BindingDB Entry DOI: 10.7270/Q2028RZ0
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50354790 (CHEMBL1834470) Show SMILES Nc1ccc(cc1)-c1nnc(Nc2ncc(cn2)C(=O)NO)o1 Show InChI InChI=1S/C13H11N7O3/c14-9-3-1-7(2-4-9)11-18-19-13(23-11)17-12-15-5-8(6-16-12)10(21)20-22/h1-6,22H,14H2,(H,20,21)(H,15,16,17,19)	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	11	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 by fluorescent activity assay				Bioorg Med Chem Lett 21: 5735-8 (2011) Article DOI: 10.1016/j.bmcl.2011.08.022 BindingDB Entry DOI: 10.7270/Q2028RZ0
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50354802 (CHEMBL1834482) Show SMILES CN(C)c1ccc(cc1)-c1nnc(Nc2ncc(cn2)C(=O)NO)s1 Show InChI InChI=1S/C15H15N7O2S/c1-22(2)11-5-3-9(4-6-11)13-19-20-15(25-13)18-14-16-7-10(8-17-14)12(23)21-24/h3-8,24H,1-2H3,(H,21,23)(H,16,17,18,20)	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	11	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 by fluorescent activity assay				Bioorg Med Chem Lett 21: 5735-8 (2011) Article DOI: 10.1016/j.bmcl.2011.08.022 BindingDB Entry DOI: 10.7270/Q2028RZ0
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50354801 (CHEMBL1834481) Show SMILES Nc1ccc(cc1)-c1nnc(Nc2ncc(cn2)C(=O)NO)s1 Show InChI InChI=1S/C13H11N7O2S/c14-9-3-1-7(2-4-9)11-18-19-13(23-11)17-12-15-5-8(6-16-12)10(21)20-22/h1-6,22H,14H2,(H,20,21)(H,15,16,17,19)	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	13	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 by fluorescent activity assay				Bioorg Med Chem Lett 21: 5735-8 (2011) Article DOI: 10.1016/j.bmcl.2011.08.022 BindingDB Entry DOI: 10.7270/Q2028RZ0
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50354784 (CHEMBL1834464) Show SMILES Cc1ccc(cc1)-c1nnc(Nc2ncc(cn2)C(=O)NO)o1 Show InChI InChI=1S/C14H12N6O3/c1-8-2-4-9(5-3-8)12-18-19-14(23-12)17-13-15-6-10(7-16-13)11(21)20-22/h2-7,22H,1H3,(H,20,21)(H,15,16,17,19)	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	14	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 by fluorescent activity assay				Bioorg Med Chem Lett 21: 5735-8 (2011) Article DOI: 10.1016/j.bmcl.2011.08.022 BindingDB Entry DOI: 10.7270/Q2028RZ0
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50354795 (CHEMBL1834475) Show SMILES Cc1ccc(cc1)-c1nnc(Nc2ncc(cn2)C(=O)NO)s1 Show InChI InChI=1S/C14H12N6O2S/c1-8-2-4-9(5-3-8)12-18-19-14(23-12)17-13-15-6-10(7-16-13)11(21)20-22/h2-7,22H,1H3,(H,20,21)(H,15,16,17,19)	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	15	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 by fluorescent activity assay				Bioorg Med Chem Lett 21: 5735-8 (2011) Article DOI: 10.1016/j.bmcl.2011.08.022 BindingDB Entry DOI: 10.7270/Q2028RZ0
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50354787 (CHEMBL1834467) Show SMILES COc1ccc(cc1)-c1nnc(Nc2ncc(cn2)C(=O)NO)o1 Show InChI InChI=1S/C14H12N6O4/c1-23-10-4-2-8(3-5-10)12-18-19-14(24-12)17-13-15-6-9(7-16-13)11(21)20-22/h2-7,22H,1H3,(H,20,21)(H,15,16,17,19)	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	16	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 by fluorescent activity assay				Bioorg Med Chem Lett 21: 5735-8 (2011) Article DOI: 10.1016/j.bmcl.2011.08.022 BindingDB Entry DOI: 10.7270/Q2028RZ0
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM19130 ((2E,4E,6R)-7-[4-(dimethylamino)phenyl]-N-hydroxy-4...) Show SMILES CC(C=CC(=O)NO)C=C(C)C(=O)c1ccc(cc1)N(C)C |w:8.7,2.1| Show InChI InChI=1S/C17H22N2O3/c1-12(5-10-16(20)18-22)11-13(2)17(21)14-6-8-15(9-7-14)19(3)4/h5-12,22H,1-4H3,(H,18,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	16	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 by fluorescent activity assay				Bioorg Med Chem Lett 21: 5735-8 (2011) Article DOI: 10.1016/j.bmcl.2011.08.022 BindingDB Entry DOI: 10.7270/Q2028RZ0
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50354785 (CHEMBL1834465) Show SMILES ONC(=O)c1cnc(Nc2nnc(o2)-c2ccc(O)cc2)nc1 Show InChI InChI=1S/C13H10N6O4/c20-9-3-1-7(2-4-9)11-17-18-13(23-11)16-12-14-5-8(6-15-12)10(21)19-22/h1-6,20,22H,(H,19,21)(H,14,15,16,18)	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	17	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 by fluorescent activity assay				Bioorg Med Chem Lett 21: 5735-8 (2011) Article DOI: 10.1016/j.bmcl.2011.08.022 BindingDB Entry DOI: 10.7270/Q2028RZ0
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50354798 (CHEMBL1834478) Show SMILES COc1ccc(cc1)-c1nnc(Nc2ncc(cn2)C(=O)NO)s1 Show InChI InChI=1S/C14H12N6O3S/c1-23-10-4-2-8(3-5-10)12-18-19-14(24-12)17-13-15-6-9(7-16-13)11(21)20-22/h2-7,22H,1H3,(H,20,21)(H,15,16,17,19)	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	17	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 by fluorescent activity assay				Bioorg Med Chem Lett 21: 5735-8 (2011) Article DOI: 10.1016/j.bmcl.2011.08.022 BindingDB Entry DOI: 10.7270/Q2028RZ0
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50354796 (CHEMBL1834476) Show SMILES ONC(=O)c1cnc(Nc2nnc(s2)-c2ccc(O)cc2)nc1 Show InChI InChI=1S/C13H10N6O3S/c20-9-3-1-7(2-4-9)11-17-18-13(23-11)16-12-14-5-8(6-15-12)10(21)19-22/h1-6,20,22H,(H,19,21)(H,14,15,16,18)	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	18	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 by fluorescent activity assay				Bioorg Med Chem Lett 21: 5735-8 (2011) Article DOI: 10.1016/j.bmcl.2011.08.022 BindingDB Entry DOI: 10.7270/Q2028RZ0
					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	290	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 by fluorescent activity assay				Bioorg Med Chem Lett 21: 5735-8 (2011) Article DOI: 10.1016/j.bmcl.2011.08.022 BindingDB Entry DOI: 10.7270/Q2028RZ0
					More data for this Ligand-Target Pair				3D Structure (crystal)
Histone deacetylase 1 (Homo sapiens (Human))	BDBM19410 (CHEMBL27759 | MS-275 | US11377423, MS-275 | US1167...) Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)OCc2cccnc2)cc1 Show InChI InChI=1S/C21H20N4O3/c22-18-5-1-2-6-19(18)25-20(26)17-9-7-15(8-10-17)13-24-21(27)28-14-16-4-3-11-23-12-16/h1-12H,13-14,22H2,(H,24,27)(H,25,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	368	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1				Eur J Med Chem 53: 390-7 (2012) Article DOI: 10.1016/j.ejmech.2012.03.058 BindingDB Entry DOI: 10.7270/Q25M66QJ
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM19410 (CHEMBL27759 | MS-275 | US11377423, MS-275 | US1167...) Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)OCc2cccnc2)cc1 Show InChI InChI=1S/C21H20N4O3/c22-18-5-1-2-6-19(18)25-20(26)17-9-7-15(8-10-17)13-24-21(27)28-14-16-4-3-11-23-12-16/h1-12H,13-14,22H2,(H,24,27)(H,25,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE 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
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 using Fluor de Lys as substrate by fluorescence analysis				Eur J Med Chem 53: 390-7 (2012) Article DOI: 10.1016/j.ejmech.2012.03.058 BindingDB Entry DOI: 10.7270/Q25M66QJ
					More data for this Ligand-Target Pair
Histone deacetylase 3 (Homo sapiens (Human))	BDBM19410 (CHEMBL27759 | MS-275 | US11377423, MS-275 | US1167...) Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)OCc2cccnc2)cc1 Show InChI InChI=1S/C21H20N4O3/c22-18-5-1-2-6-19(18)25-20(26)17-9-7-15(8-10-17)13-24-21(27)28-14-16-4-3-11-23-12-16/h1-12H,13-14,22H2,(H,24,27)(H,25,26)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	501	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC3				Eur J Med Chem 53: 390-7 (2012) Article DOI: 10.1016/j.ejmech.2012.03.058 BindingDB Entry DOI: 10.7270/Q25M66QJ
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50385017 (CHEMBL2035393) Show SMILES Nc1ccccc1NC(=O)c1ccc(NCC(=O)Nc2ccc(cc2)[N+]([O-])=O)cc1 Show InChI InChI=1S/C21H19N5O4/c22-18-3-1-2-4-19(18)25-21(28)14-5-7-15(8-6-14)23-13-20(27)24-16-9-11-17(12-10-16)26(29)30/h1-12,23H,13,22H2,(H,24,27)(H,25,28)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	700	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 using Fluor de Lys as substrate by fluorescence analysis				Eur J Med Chem 53: 390-7 (2012) Article DOI: 10.1016/j.ejmech.2012.03.058 BindingDB Entry DOI: 10.7270/Q25M66QJ
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50385007 (CHEMBL2035382) Show SMILES Nc1ccccc1NC(=O)CCCNCC(=O)Nc1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C18H21N5O4/c19-15-4-1-2-5-16(15)22-17(24)6-3-11-20-12-18(25)21-13-7-9-14(10-8-13)23(26)27/h1-2,4-5,7-10,20H,3,6,11-12,19H2,(H,21,25)(H,22,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	900	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 using Fluor de Lys as substrate by fluorescence analysis				Eur J Med Chem 53: 390-7 (2012) Article DOI: 10.1016/j.ejmech.2012.03.058 BindingDB Entry DOI: 10.7270/Q25M66QJ
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50385015 (CHEMBL2035390) Show SMILES Nc1ccccc1NC(=O)c1ccc(NCC(=O)Nc2ccc(Cl)cc2)cc1 Show InChI InChI=1S/C21H19ClN4O2/c22-15-7-11-17(12-8-15)25-20(27)13-24-16-9-5-14(6-10-16)21(28)26-19-4-2-1-3-18(19)23/h1-12,24H,13,23H2,(H,25,27)(H,26,28)	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+3	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 using Fluor de Lys as substrate by fluorescence analysis				Eur J Med Chem 53: 390-7 (2012) Article DOI: 10.1016/j.ejmech.2012.03.058 BindingDB Entry DOI: 10.7270/Q25M66QJ
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50385004 (CHEMBL2035379) Show SMILES Nc1ccccc1NC(=O)CCCNCC(=O)Nc1ccc(Cl)cc1 Show InChI InChI=1S/C18H21ClN4O2/c19-13-7-9-14(10-8-13)22-18(25)12-21-11-3-6-17(24)23-16-5-2-1-4-15(16)20/h1-2,4-5,7-10,21H,3,6,11-12,20H2,(H,22,25)(H,23,24)	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	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 using Fluor de Lys as substrate by fluorescence analysis				Eur J Med Chem 53: 390-7 (2012) Article DOI: 10.1016/j.ejmech.2012.03.058 BindingDB Entry DOI: 10.7270/Q25M66QJ
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50385021 (CHEMBL2035392) Show SMILES Nc1ccccc1NC(=O)c1ccc(NCC(=O)Nc2cccc(c2)[N+]([O-])=O)cc1 Show InChI InChI=1S/C21H19N5O4/c22-18-6-1-2-7-19(18)25-21(28)14-8-10-15(11-9-14)23-13-20(27)24-16-4-3-5-17(12-16)26(29)30/h1-12,23H,13,22H2,(H,24,27)(H,25,28)	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	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 using Fluor de Lys as substrate by fluorescence analysis				Eur J Med Chem 53: 390-7 (2012) Article DOI: 10.1016/j.ejmech.2012.03.058 BindingDB Entry DOI: 10.7270/Q25M66QJ
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50385012 (CHEMBL2035387) Show SMILES Nc1ccccc1NC(=O)c1ccc(NCC(=O)Nc2ccc(Br)cc2)cc1 Show InChI InChI=1S/C21H19BrN4O2/c22-15-7-11-17(12-8-15)25-20(27)13-24-16-9-5-14(6-10-16)21(28)26-19-4-2-1-3-18(19)23/h1-12,24H,13,23H2,(H,25,27)(H,26,28)	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	1.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 using Fluor de Lys as substrate by fluorescence analysis				Eur J Med Chem 53: 390-7 (2012) Article DOI: 10.1016/j.ejmech.2012.03.058 BindingDB Entry DOI: 10.7270/Q25M66QJ
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50385001 (CHEMBL2034986) Show SMILES Nc1ccccc1NC(=O)CCCNCC(=O)Nc1ccc(Br)cc1 Show InChI InChI=1S/C18H21BrN4O2/c19-13-7-9-14(10-8-13)22-18(25)12-21-11-3-6-17(24)23-16-5-2-1-4-15(16)20/h1-2,4-5,7-10,21H,3,6,11-12,20H2,(H,22,25)(H,23,24)	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	1.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 using Fluor de Lys as substrate by fluorescence analysis				Eur J Med Chem 53: 390-7 (2012) Article DOI: 10.1016/j.ejmech.2012.03.058 BindingDB Entry DOI: 10.7270/Q25M66QJ
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50385003 (CHEMBL2035378) Show SMILES Nc1ccccc1NC(=O)CCCNCC(=O)Nc1cccc(Cl)c1 Show InChI InChI=1S/C18H21ClN4O2/c19-13-5-3-6-14(11-13)22-18(25)12-21-10-4-9-17(24)23-16-8-2-1-7-15(16)20/h1-3,5-8,11,21H,4,9-10,12,20H2,(H,22,25)(H,23,24)	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	1.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 using Fluor de Lys as substrate by fluorescence analysis				Eur J Med Chem 53: 390-7 (2012) Article DOI: 10.1016/j.ejmech.2012.03.058 BindingDB Entry DOI: 10.7270/Q25M66QJ
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50385016 (CHEMBL2035391) Show SMILES Nc1ccccc1NC(=O)c1ccc(NCC(=O)Nc2ccccc2[N+]([O-])=O)cc1 Show InChI InChI=1S/C21H19N5O4/c22-16-5-1-2-6-17(16)25-21(28)14-9-11-15(12-10-14)23-13-20(27)24-18-7-3-4-8-19(18)26(29)30/h1-12,23H,13,22H2,(H,24,27)(H,25,28)	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	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 using Fluor de Lys as substrate by fluorescence analysis				Eur J Med Chem 53: 390-7 (2012) Article DOI: 10.1016/j.ejmech.2012.03.058 BindingDB Entry DOI: 10.7270/Q25M66QJ
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50385006 (CHEMBL2035381) Show SMILES Nc1ccccc1NC(=O)CCCNCC(=O)Nc1cccc(c1)[N+]([O-])=O Show InChI InChI=1S/C18H21N5O4/c19-15-7-1-2-8-16(15)22-17(24)9-4-10-20-12-18(25)21-13-5-3-6-14(11-13)23(26)27/h1-3,5-8,11,20H,4,9-10,12,19H2,(H,21,25)(H,22,24)	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	2.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 using Fluor de Lys as substrate by fluorescence analysis				Eur J Med Chem 53: 390-7 (2012) Article DOI: 10.1016/j.ejmech.2012.03.058 BindingDB Entry DOI: 10.7270/Q25M66QJ
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50385014 (CHEMBL2035389) Show SMILES Nc1ccccc1NC(=O)c1ccc(NCC(=O)Nc2cccc(Cl)c2)cc1 Show InChI InChI=1S/C21H19ClN4O2/c22-15-4-3-5-17(12-15)25-20(27)13-24-16-10-8-14(9-11-16)21(28)26-19-7-2-1-6-18(19)23/h1-12,24H,13,23H2,(H,25,27)(H,26,28)	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	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 using Fluor de Lys as substrate by fluorescence analysis				Eur J Med Chem 53: 390-7 (2012) Article DOI: 10.1016/j.ejmech.2012.03.058 BindingDB Entry DOI: 10.7270/Q25M66QJ
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50385002 (CHEMBL2035377) Show SMILES Nc1ccccc1NC(=O)CCCNCC(=O)Nc1ccccc1Cl Show InChI InChI=1S/C18H21ClN4O2/c19-13-6-1-3-8-15(13)22-18(25)12-21-11-5-10-17(24)23-16-9-4-2-7-14(16)20/h1-4,6-9,21H,5,10-12,20H2,(H,22,25)(H,23,24)	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	2.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 using Fluor de Lys as substrate by fluorescence analysis				Eur J Med Chem 53: 390-7 (2012) Article DOI: 10.1016/j.ejmech.2012.03.058 BindingDB Entry DOI: 10.7270/Q25M66QJ
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50385013 (CHEMBL2035388) Show SMILES Nc1ccccc1NC(=O)c1ccc(NCC(=O)Nc2ccccc2Cl)cc1 Show InChI InChI=1S/C21H19ClN4O2/c22-16-5-1-3-7-18(16)25-20(27)13-24-15-11-9-14(10-12-15)21(28)26-19-8-4-2-6-17(19)23/h1-12,24H,13,23H2,(H,25,27)(H,26,28)	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	2.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 using Fluor de Lys as substrate by fluorescence analysis				Eur J Med Chem 53: 390-7 (2012) Article DOI: 10.1016/j.ejmech.2012.03.058 BindingDB Entry DOI: 10.7270/Q25M66QJ
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50385005 (CHEMBL2035380) Show SMILES Nc1ccccc1NC(=O)CCCNCC(=O)Nc1ccccc1[N+]([O-])=O Show InChI InChI=1S/C18H21N5O4/c19-13-6-1-2-7-14(13)21-17(24)10-5-11-20-12-18(25)22-15-8-3-4-9-16(15)23(26)27/h1-4,6-9,20H,5,10-12,19H2,(H,21,24)(H,22,25)	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	3.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 using Fluor de Lys as substrate by fluorescence analysis				Eur J Med Chem 53: 390-7 (2012) Article DOI: 10.1016/j.ejmech.2012.03.058 BindingDB Entry DOI: 10.7270/Q25M66QJ
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50385018 (CHEMBL2035394) Show SMILES COc1ccc(NC(=O)CNc2ccc(cc2)C(=O)Nc2ccccc2N)cc1 Show InChI InChI=1S/C22H22N4O3/c1-29-18-12-10-17(11-13-18)25-21(27)14-24-16-8-6-15(7-9-16)22(28)26-20-5-3-2-4-19(20)23/h2-13,24H,14,23H2,1H3,(H,25,27)(H,26,28)	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	3.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 using Fluor de Lys as substrate by fluorescence analysis				Eur J Med Chem 53: 390-7 (2012) Article DOI: 10.1016/j.ejmech.2012.03.058 BindingDB Entry DOI: 10.7270/Q25M66QJ
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50385008 (CHEMBL2035383) Show SMILES COc1ccc(NC(=O)CNCCCC(=O)Nc2ccccc2N)cc1 Show InChI InChI=1S/C19H24N4O3/c1-26-15-10-8-14(9-11-15)22-19(25)13-21-12-4-7-18(24)23-17-6-3-2-5-16(17)20/h2-3,5-6,8-11,21H,4,7,12-13,20H2,1H3,(H,22,25)(H,23,24)	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	3.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 using Fluor de Lys as substrate by fluorescence analysis				Eur J Med Chem 53: 390-7 (2012) Article DOI: 10.1016/j.ejmech.2012.03.058 BindingDB Entry DOI: 10.7270/Q25M66QJ
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50385019 (CHEMBL2035395) Show SMILES Cc1ccc(NC(=O)CNc2ccc(cc2)C(=O)Nc2ccccc2N)cc1 Show InChI InChI=1S/C22H22N4O2/c1-15-6-10-18(11-7-15)25-21(27)14-24-17-12-8-16(9-13-17)22(28)26-20-5-3-2-4-19(20)23/h2-13,24H,14,23H2,1H3,(H,25,27)(H,26,28)	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	4.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 using Fluor de Lys as substrate by fluorescence analysis				Eur J Med Chem 53: 390-7 (2012) Article DOI: 10.1016/j.ejmech.2012.03.058 BindingDB Entry DOI: 10.7270/Q25M66QJ
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50385011 (CHEMBL2035386) Show SMILES Nc1ccccc1NC(=O)c1ccc(NCC(=O)Nc2ccccc2)cc1 Show InChI InChI=1S/C21H20N4O2/c22-18-8-4-5-9-19(18)25-21(27)15-10-12-16(13-11-15)23-14-20(26)24-17-6-2-1-3-7-17/h1-13,23H,14,22H2,(H,24,26)(H,25,27)	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	7.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 using Fluor de Lys as substrate by fluorescence analysis				Eur J Med Chem 53: 390-7 (2012) Article DOI: 10.1016/j.ejmech.2012.03.058 BindingDB Entry DOI: 10.7270/Q25M66QJ
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50385009 (CHEMBL2035384) Show SMILES Cc1ccc(NC(=O)CNCCCC(=O)Nc2ccccc2N)cc1 Show InChI InChI=1S/C19H24N4O2/c1-14-8-10-15(11-9-14)22-19(25)13-21-12-4-7-18(24)23-17-6-3-2-5-16(17)20/h2-3,5-6,8-11,21H,4,7,12-13,20H2,1H3,(H,22,25)(H,23,24)	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	7.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 using Fluor de Lys as substrate by fluorescence analysis				Eur J Med Chem 53: 390-7 (2012) Article DOI: 10.1016/j.ejmech.2012.03.058 BindingDB Entry DOI: 10.7270/Q25M66QJ
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50385020 (CHEMBL2035396) Show SMILES Nc1ccccc1NC(=O)c1ccc(NCC(=O)Nc2cc(Cl)ccc2Cl)cc1 Show InChI InChI=1S/C21H18Cl2N4O2/c22-14-7-10-16(23)19(11-14)26-20(28)12-25-15-8-5-13(6-9-15)21(29)27-18-4-2-1-3-17(18)24/h1-11,25H,12,24H2,(H,26,28)(H,27,29)	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	8.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 using Fluor de Lys as substrate by fluorescence analysis				Eur J Med Chem 53: 390-7 (2012) Article DOI: 10.1016/j.ejmech.2012.03.058 BindingDB Entry DOI: 10.7270/Q25M66QJ
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50385010 (CHEMBL2035385) Show SMILES Nc1ccccc1NC(=O)CCCNCC(=O)Nc1cc(Cl)ccc1Cl Show InChI InChI=1S/C18H20Cl2N4O2/c19-12-7-8-13(20)16(10-12)24-18(26)11-22-9-3-6-17(25)23-15-5-2-1-4-14(15)21/h1-2,4-5,7-8,10,22H,3,6,9,11,21H2,(H,23,25)(H,24,26)	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	8.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 using Fluor de Lys as substrate by fluorescence analysis				Eur J Med Chem 53: 390-7 (2012) Article DOI: 10.1016/j.ejmech.2012.03.058 BindingDB Entry DOI: 10.7270/Q25M66QJ
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50385000 (CHEMBL2035376) Show SMILES Nc1ccccc1NC(=O)CCCNCC(=O)Nc1ccccc1 Show InChI InChI=1S/C18H22N4O2/c19-15-9-4-5-10-16(15)22-17(23)11-6-12-20-13-18(24)21-14-7-2-1-3-8-14/h1-5,7-10,20H,6,11-13,19H2,(H,21,24)(H,22,23)	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	9.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC1 using Fluor de Lys as substrate by fluorescence analysis				Eur J Med Chem 53: 390-7 (2012) Article DOI: 10.1016/j.ejmech.2012.03.058 BindingDB Entry DOI: 10.7270/Q25M66QJ
					More data for this Ligand-Target Pair
Histone deacetylase 4 (Homo sapiens (Human))	BDBM19410 (CHEMBL27759 | MS-275 | US11377423, MS-275 | US1167...) Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)OCc2cccnc2)cc1 Show InChI InChI=1S/C21H20N4O3/c22-18-5-1-2-6-19(18)25-20(26)17-9-7-15(8-10-17)13-24-21(27)28-14-16-4-3-11-23-12-16/h1-12H,13-14,22H2,(H,24,27)(H,25,26)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.07E+4	n/a	n/a	n/a	n/a	n/a	n/a
Guru Ghasidas University Curated by ChEMBL					Assay Description Inhibition of HDAC4				Eur J Med Chem 53: 390-7 (2012) Article DOI: 10.1016/j.ejmech.2012.03.058 BindingDB Entry DOI: 10.7270/Q25M66QJ
					More data for this Ligand-Target Pair

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