Compile Data Set for Download or QSAR

Found 23 hits Enz. Inhib. hit(s) with all data for entry = 50037208   

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 4 (Homo sapiens (Human))	BDBM50134803 (5,8-Dimethyl-11-(6-oxiranyl-6-oxo-hexyl)-decahydro...) Show SMILES C[C@@H]1NC(=O)[C@H](CCCCCC(=O)C2CO2)NC(=O)[C@H]2CCCN2C(=O)[C@H](C)NC1=O Show InChI InChI=1S/C21H32N4O6/c1-12-18(27)23-13(2)21(30)25-10-6-8-15(25)20(29)24-14(19(28)22-12)7-4-3-5-9-16(26)17-11-31-17/h12-15,17H,3-11H2,1-2H3,(H,22,28)(H,23,27)(H,24,29)/t12-,13-,14-,15+,17?/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.300	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma"La Sapienza" Curated by ChEMBL					Assay Description Inhibition of Histone deacetylase 4 in mammalian cells.				J Med Chem 46: 4826-9 (2003) Article DOI: 10.1021/jm034167p BindingDB Entry DOI: 10.7270/Q28C9X0G
					More data for this Ligand-Target Pair
Histone deacetylase 4 (Homo sapiens (Human))	BDBM50134799 (6-((5S,8S,11S,13aR)-5,8-Dimethyl-4,7,10,13-tetraox...) Show SMILES C[C@@H]1NC(=O)[C@H](CCCCCC(=O)NO)NC(=O)[C@H]2CCCN2C(=O)[C@H](C)NC1=O Show InChI InChI=1S/C19H31N5O6/c1-11-16(26)21-12(2)19(29)24-10-6-8-14(24)18(28)22-13(17(27)20-11)7-4-3-5-9-15(25)23-30/h11-14,30H,3-10H2,1-2H3,(H,20,27)(H,21,26)(H,22,28)(H,23,25)/t11-,12-,13-,14+/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.70	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma"La Sapienza" Curated by ChEMBL					Assay Description Inhibition of Histone deacetylase 4 in mammalian cells.				J Med Chem 46: 4826-9 (2003) Article DOI: 10.1021/jm034167p BindingDB Entry DOI: 10.7270/Q28C9X0G
					More data for this Ligand-Target Pair
Histone deacetylase 2b (Zea mays)	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)	KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	7.20	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma"La Sapienza" Curated by ChEMBL					Assay Description Inhibitory activity against maize Histone deacetylase 2 at 1 mM				J Med Chem 46: 4826-9 (2003) Article DOI: 10.1021/jm034167p BindingDB Entry DOI: 10.7270/Q28C9X0G
					More data for this Ligand-Target Pair
Histone deacetylase 2b (Zea mays)	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)	KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma"La Sapienza" Curated by ChEMBL					Assay Description Tested for maize Histone deacetylase 2 inhibitory activity				J Med Chem 46: 4826-9 (2003) Article DOI: 10.1021/jm034167p BindingDB Entry DOI: 10.7270/Q28C9X0G
					More data for this Ligand-Target Pair
Histone deacetylase 2b (Zea mays)	BDBM50134800 ((E)-N-Hydroxy-3-[1-methyl-4-((E)-3-oxo-3-o-tolyl-p...) Show SMILES Cc1ccccc1C(=O)C=Cc1cc(C=CC(=O)NO)n(C)c1 |w:10.11,14.14| Show InChI InChI=1S/C18H18N2O3/c1-13-5-3-4-6-16(13)17(21)9-7-14-11-15(20(2)12-14)8-10-18(22)19-23/h3-12,23H,1-2H3,(H,19,22)	KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	270	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma"La Sapienza" Curated by ChEMBL					Assay Description Tested for maize Histone deacetylase 2 inhibitory activity				J Med Chem 46: 4826-9 (2003) Article DOI: 10.1021/jm034167p BindingDB Entry DOI: 10.7270/Q28C9X0G
					More data for this Ligand-Target Pair
Histone deacetylase 2b (Zea mays)	BDBM50134804 ((E)-N-Hydroxy-3-[1-methyl-4-((E)-3-oxo-3-phenyl-pr...) Show SMILES Cn1cc(\C=C\C(=O)c2ccccc2)cc1\C=C\C(=O)NO Show InChI InChI=1S/C17H16N2O3/c1-19-12-13(11-15(19)8-10-17(21)18-22)7-9-16(20)14-5-3-2-4-6-14/h2-12,22H,1H3,(H,18,21)/b9-7+,10-8+	KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	280	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma"La Sapienza" Curated by ChEMBL					Assay Description Tested for maize Histone deacetylase 2 inhibitory activity				J Med Chem 46: 4826-9 (2003) Article DOI: 10.1021/jm034167p BindingDB Entry DOI: 10.7270/Q28C9X0G
					More data for this Ligand-Target Pair
Histone deacetylase 4 (Homo sapiens (Human))	BDBM50354086 (FK-228 | Istodax | ROMIDEPSIN) Show SMILES C\C=C1/NC(=O)[C@@H](CS)NC(=O)[C@H](CC(=O)C[C@H](OC(=O)[C@@H](NC1=O)C(C)C)\C=C\CCS)C(C)C |r| Show InChI InChI=1S/C25H39N3O6S2/c1-6-19-23(31)28-21(15(4)5)25(33)34-17(9-7-8-10-35)11-16(29)12-18(14(2)3)22(30)27-20(13-36)24(32)26-19/h6-7,9,14-15,17-18,20-21,35-36H,8,10-13H2,1-5H3,(H,26,32)(H,27,30)(H,28,31)/b9-7+,19-6-/t17-,18-,20-,21+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	510	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma"La Sapienza" Curated by ChEMBL					Assay Description Inhibition of Histone deacetylase 4 in mammalian cells.				J Med Chem 46: 4826-9 (2003) Article DOI: 10.1021/jm034167p BindingDB Entry DOI: 10.7270/Q28C9X0G
					More data for this Ligand-Target Pair
Histone deacetylase 2b (Zea mays)	BDBM50134802 ((E)-3-{4-[(E)-3-(2-Chloro-phenyl)-3-oxo-propenyl]-...) Show SMILES Cn1cc(\C=C\C(=O)c2ccccc2Cl)cc1\C=C\C(=O)NO Show InChI InChI=1S/C17H15ClN2O3/c1-20-11-12(10-13(20)7-9-17(22)19-23)6-8-16(21)14-4-2-3-5-15(14)18/h2-11,23H,1H3,(H,19,22)/b8-6+,9-7+	KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma"La Sapienza" Curated by ChEMBL					Assay Description Tested for maize Histone deacetylase 2 inhibitory activity				J Med Chem 46: 4826-9 (2003) Article DOI: 10.1021/jm034167p BindingDB Entry DOI: 10.7270/Q28C9X0G
					More data for this Ligand-Target Pair
Histone deacetylase 2b (Zea mays)	BDBM50134795 ((E)-N-Hydroxy-3-[1-methyl-4-((E)-3-oxo-3-m-tolyl-p...) Show SMILES Cc1cccc(c1)C(=O)\C=C\c1cc(\C=C\C(=O)NO)n(C)c1 Show InChI InChI=1S/C18H18N2O3/c1-13-4-3-5-15(10-13)17(21)8-6-14-11-16(20(2)12-14)7-9-18(22)19-23/h3-12,23H,1-2H3,(H,19,22)/b8-6+,9-7+	KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma"La Sapienza" Curated by ChEMBL					Assay Description Tested for maize Histone deacetylase 2 inhibitory activity				J Med Chem 46: 4826-9 (2003) Article DOI: 10.1021/jm034167p BindingDB Entry DOI: 10.7270/Q28C9X0G
					More data for this Ligand-Target Pair
Histone deacetylase 2b (Zea mays)	BDBM50134797 ((E)-N-Hydroxy-3-[1-methyl-4-((E)-3-oxo-3-p-tolyl-p...) Show SMILES Cc1ccc(cc1)C(=O)\C=C\c1cc(\C=C\C(=O)NO)n(C)c1 Show InChI InChI=1S/C18H18N2O3/c1-13-3-6-15(7-4-13)17(21)9-5-14-11-16(20(2)12-14)8-10-18(22)19-23/h3-12,23H,1-2H3,(H,19,22)/b9-5+,10-8+	KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.02E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma"La Sapienza" Curated by ChEMBL					Assay Description Tested for maize Histone deacetylase 2 inhibitory activity				J Med Chem 46: 4826-9 (2003) Article DOI: 10.1021/jm034167p BindingDB Entry DOI: 10.7270/Q28C9X0G
					More data for this Ligand-Target Pair
Histone deacetylase 2b (Zea mays)	BDBM50134796 ((E)-3-{4-[(E)-3-(3-Chloro-phenyl)-3-oxo-propenyl]-...) Show SMILES Cn1cc(\C=C\C(=O)c2cccc(Cl)c2)cc1\C=C\C(=O)NO Show InChI InChI=1S/C17H15ClN2O3/c1-20-11-12(9-15(20)6-8-17(22)19-23)5-7-16(21)13-3-2-4-14(18)10-13/h2-11,23H,1H3,(H,19,22)/b7-5+,8-6+	KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.42E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma"La Sapienza" Curated by ChEMBL					Assay Description Tested for maize Histone deacetylase 2 inhibitory activity				J Med Chem 46: 4826-9 (2003) Article DOI: 10.1021/jm034167p BindingDB Entry DOI: 10.7270/Q28C9X0G
					More data for this Ligand-Target Pair
Histone deacetylase 2b (Zea mays)	BDBM50134801 ((E)-3-{4-[(E)-3-(4-Chloro-phenyl)-3-oxo-propenyl]-...) Show SMILES Cn1cc(\C=C\C(=O)c2ccc(Cl)cc2)cc1\C=C\C(=O)NO Show InChI InChI=1S/C17H15ClN2O3/c1-20-11-12(10-15(20)7-9-17(22)19-23)2-8-16(21)13-3-5-14(18)6-4-13/h2-11,23H,1H3,(H,19,22)/b8-2+,9-7+	KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.52E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma"La Sapienza" Curated by ChEMBL					Assay Description Tested for maize Histone deacetylase 2 inhibitory activity				J Med Chem 46: 4826-9 (2003) Article DOI: 10.1021/jm034167p BindingDB Entry DOI: 10.7270/Q28C9X0G
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Homo sapiens (Human))	BDBM50134805 (6,9-Dibenzyl-12-(6-oxiranyl-6-oxo-hexyl)-decahydro...) Show SMILES O=C(CCCCC[C@@H]1NC(=O)[C@H]2CCCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC1=O)C1CO1 Show InChI InChI=1S/C34H42N4O6/c39-29(30-22-44-30)18-9-3-8-16-25-31(40)36-26(20-23-12-4-1-5-13-23)32(41)37-27(21-24-14-6-2-7-15-24)34(43)38-19-11-10-17-28(38)33(42)35-25/h1-2,4-7,12-15,25-28,30H,3,8-11,16-22H2,(H,35,42)(H,36,40)(H,37,41)/t25-,26-,27-,28+,30?/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	5.24E+5	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma"La Sapienza" Curated by ChEMBL					Assay Description Tested for inhibition of Histone deacetylase 6 induced acetylated tubulin in mammalian cells.				J Med Chem 46: 4826-9 (2003) Article DOI: 10.1021/jm034167p BindingDB Entry DOI: 10.7270/Q28C9X0G
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50134805 (6,9-Dibenzyl-12-(6-oxiranyl-6-oxo-hexyl)-decahydro...) Show SMILES O=C(CCCCC[C@@H]1NC(=O)[C@H]2CCCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC1=O)C1CO1 Show InChI InChI=1S/C34H42N4O6/c39-29(30-22-44-30)18-9-3-8-16-25-31(40)36-26(20-23-12-4-1-5-13-23)32(41)37-27(21-24-14-6-2-7-15-24)34(43)38-19-11-10-17-28(38)33(42)35-25/h1-2,4-7,12-15,25-28,30H,3,8-11,16-22H2,(H,35,42)(H,36,40)(H,37,41)/t25-,26-,27-,28+,30?/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	820	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma"La Sapienza" Curated by ChEMBL					Assay Description Inhibition of Histone deacetylase 1 induced acetylated histone in mammalian cells				J Med Chem 46: 4826-9 (2003) Article DOI: 10.1021/jm034167p BindingDB Entry DOI: 10.7270/Q28C9X0G
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50354086 (FK-228 | Istodax | ROMIDEPSIN) Show SMILES C\C=C1/NC(=O)[C@@H](CS)NC(=O)[C@H](CC(=O)C[C@H](OC(=O)[C@@H](NC1=O)C(C)C)\C=C\CCS)C(C)C |r| Show InChI InChI=1S/C25H39N3O6S2/c1-6-19-23(31)28-21(15(4)5)25(33)34-17(9-7-8-10-35)11-16(29)12-18(14(2)3)22(30)27-20(13-36)24(32)26-19/h6-7,9,14-15,17-18,20-21,35-36H,8,10-13H2,1-5H3,(H,26,32)(H,27,30)(H,28,31)/b9-7+,19-6-/t17-,18-,20-,21+/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	3.60E+4	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma"La Sapienza" Curated by ChEMBL					Assay Description Inhibition of Histone deacetylase 1 induced acetylated histone in mammalian cells.				J Med Chem 46: 4826-9 (2003) Article DOI: 10.1021/jm034167p BindingDB Entry DOI: 10.7270/Q28C9X0G
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Homo sapiens (Human))	BDBM50134803 (5,8-Dimethyl-11-(6-oxiranyl-6-oxo-hexyl)-decahydro...) Show SMILES C[C@@H]1NC(=O)[C@H](CCCCCC(=O)C2CO2)NC(=O)[C@H]2CCCN2C(=O)[C@H](C)NC1=O Show InChI InChI=1S/C21H32N4O6/c1-12-18(27)23-13(2)21(30)25-10-6-8-15(25)20(29)24-14(19(28)22-12)7-4-3-5-9-16(26)17-11-31-17/h12-15,17H,3-11H2,1-2H3,(H,22,28)(H,23,27)(H,24,29)/t12-,13-,14-,15+,17?/m0/s1	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	n/a	n/a	3.60E+5	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma"La Sapienza" Curated by ChEMBL					Assay Description Tested for inhibition of Histone deacetylase 6 induced acetylated tubulin in mammalian cells.				J Med Chem 46: 4826-9 (2003) Article DOI: 10.1021/jm034167p BindingDB Entry DOI: 10.7270/Q28C9X0G
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Homo sapiens (Human))	BDBM22449 (CHEMBL356769 | N-(4-{(2R,4R,6S)-4-{[(4,5-diphenyl-...) Show SMILES OCc1ccc(cc1)[C@@H]1C[C@H](CSc2nc(c(o2)-c2ccccc2)-c2ccccc2)O[C@@H](O1)c1ccc(NC(=O)CCCCCCC(=O)NO)cc1 |r| Show InChI InChI=1S/C41H43N3O7S/c45-26-28-17-19-29(20-18-28)35-25-34(27-52-41-43-38(30-11-5-3-6-12-30)39(51-41)31-13-7-4-8-14-31)49-40(50-35)32-21-23-33(24-22-32)42-36(46)15-9-1-2-10-16-37(47)44-48/h3-8,11-14,17-24,34-35,40,45,48H,1-2,9-10,15-16,25-27H2,(H,42,46)(H,44,47)/t34-,35+,40+/m1/s1	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	n/a	n/a	2.90E+3	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma"La Sapienza" Curated by ChEMBL					Assay Description Tested for inhibition of Histone deacetylase 6 induced acetylated tubulin in mammalian cells.				J Med Chem 46: 4826-9 (2003) Article DOI: 10.1021/jm034167p BindingDB Entry DOI: 10.7270/Q28C9X0G
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50134803 (5,8-Dimethyl-11-(6-oxiranyl-6-oxo-hexyl)-decahydro...) Show SMILES C[C@@H]1NC(=O)[C@H](CCCCCC(=O)C2CO2)NC(=O)[C@H]2CCCN2C(=O)[C@H](C)NC1=O Show InChI InChI=1S/C21H32N4O6/c1-12-18(27)23-13(2)21(30)25-10-6-8-15(25)20(29)24-14(19(28)22-12)7-4-3-5-9-16(26)17-11-31-17/h12-15,17H,3-11H2,1-2H3,(H,22,28)(H,23,27)(H,24,29)/t12-,13-,14-,15+,17?/m0/s1	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	n/a	n/a	110	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma"La Sapienza" Curated by ChEMBL					Assay Description Inhibition of Histone deacetylase 1 induced acetylated histone in mammalian cells.				J Med Chem 46: 4826-9 (2003) Article DOI: 10.1021/jm034167p BindingDB Entry DOI: 10.7270/Q28C9X0G
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM50134799 (6-((5S,8S,11S,13aR)-5,8-Dimethyl-4,7,10,13-tetraox...) Show SMILES C[C@@H]1NC(=O)[C@H](CCCCCC(=O)NO)NC(=O)[C@H]2CCCN2C(=O)[C@H](C)NC1=O Show InChI InChI=1S/C19H31N5O6/c1-11-16(26)21-12(2)19(29)24-10-6-8-14(24)18(28)22-13(17(27)20-11)7-4-3-5-9-15(25)23-30/h11-14,30H,3-10H2,1-2H3,(H,20,27)(H,21,26)(H,22,28)(H,23,25)/t11-,12-,13-,14+/m0/s1	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	n/a	n/a	1.90E+3	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma"La Sapienza" Curated by ChEMBL					Assay Description Inhibition of Histone deacetylase 1 induced acetylated histone in mammalian cells.				J Med Chem 46: 4826-9 (2003) Article DOI: 10.1021/jm034167p BindingDB Entry DOI: 10.7270/Q28C9X0G
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Homo sapiens (Human))	BDBM50134799 (6-((5S,8S,11S,13aR)-5,8-Dimethyl-4,7,10,13-tetraox...) Show SMILES C[C@@H]1NC(=O)[C@H](CCCCCC(=O)NO)NC(=O)[C@H]2CCCN2C(=O)[C@H](C)NC1=O Show InChI InChI=1S/C19H31N5O6/c1-11-16(26)21-12(2)19(29)24-10-6-8-14(24)18(28)22-13(17(27)20-11)7-4-3-5-9-15(25)23-30/h11-14,30H,3-10H2,1-2H3,(H,20,27)(H,21,26)(H,22,28)(H,23,25)/t11-,12-,13-,14+/m0/s1	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	n/a	n/a	1.90E+4	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma"La Sapienza" Curated by ChEMBL					Assay Description Tested for inhibition of Histone deacetylase 6 induced acetylated tubulin in mammalian cells.				J Med Chem 46: 4826-9 (2003) Article DOI: 10.1021/jm034167p BindingDB Entry DOI: 10.7270/Q28C9X0G
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Homo sapiens (Human))	BDBM50354086 (FK-228 | Istodax | ROMIDEPSIN) Show SMILES C\C=C1/NC(=O)[C@@H](CS)NC(=O)[C@H](CC(=O)C[C@H](OC(=O)[C@@H](NC1=O)C(C)C)\C=C\CCS)C(C)C |r| Show InChI InChI=1S/C25H39N3O6S2/c1-6-19-23(31)28-21(15(4)5)25(33)34-17(9-7-8-10-35)11-16(29)12-18(14(2)3)22(30)27-20(13-36)24(32)26-19/h6-7,9,14-15,17-18,20-21,35-36H,8,10-13H2,1-5H3,(H,26,32)(H,27,30)(H,28,31)/b9-7+,19-6-/t17-,18-,20-,21+/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.40E+7	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma"La Sapienza" Curated by ChEMBL					Assay Description Tested for inhibition of Histone deacetylase 6 induced acetylated tubulin in mammalian cells.				J Med Chem 46: 4826-9 (2003) Article DOI: 10.1021/jm034167p BindingDB Entry DOI: 10.7270/Q28C9X0G
					More data for this Ligand-Target Pair
Histone deacetylase 1 (Homo sapiens (Human))	BDBM22449 (CHEMBL356769 | N-(4-{(2R,4R,6S)-4-{[(4,5-diphenyl-...) Show SMILES OCc1ccc(cc1)[C@@H]1C[C@H](CSc2nc(c(o2)-c2ccccc2)-c2ccccc2)O[C@@H](O1)c1ccc(NC(=O)CCCCCCC(=O)NO)cc1 |r| Show InChI InChI=1S/C41H43N3O7S/c45-26-28-17-19-29(20-18-28)35-25-34(27-52-41-43-38(30-11-5-3-6-12-30)39(51-41)31-13-7-4-8-14-31)49-40(50-35)32-21-23-33(24-22-32)42-36(46)15-9-1-2-10-16-37(47)44-48/h3-8,11-14,17-24,34-35,40,45,48H,1-2,9-10,15-16,25-27H2,(H,42,46)(H,44,47)/t34-,35+,40+/m1/s1	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	n/a	n/a	2.17E+5	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma"La Sapienza" Curated by ChEMBL					Assay Description Inhibition of Histone deacetylase 1 induced acetylated histone in mammalian cells.				J Med Chem 46: 4826-9 (2003) Article DOI: 10.1021/jm034167p BindingDB Entry DOI: 10.7270/Q28C9X0G
					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	n/a	n/a	6.00E+3	n/a	n/a	n/a	n/a
Universit£ degli Studi di Roma"La Sapienza" Curated by ChEMBL					Assay Description Inhibition of Histone deacetylase 1 induced acetylated histone in mammalian cells.				J Med Chem 46: 4826-9 (2003) Article DOI: 10.1021/jm034167p BindingDB Entry DOI: 10.7270/Q28C9X0G
					More data for this Ligand-Target Pair