Found 10 hits Enz. Inhib. hit(s) with all data for entry = 50004582 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
(Homo sapiens (Human)) | BDBM19149
(CHEMBL98 | N-hydroxy-N'-phenyloctanediamide | SAHA...)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
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| Purchase
CHEMBL
DrugBank
MCE
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| PDB
Article
PubMed
| n/a | n/a | 79 | n/a | n/a | n/a | n/a | n/a | n/a |
Menarini Ricerche Pomezia
Curated by ChEMBL
| Assay Description
Inhibition of HDAC in human HeLa cell extract assessed as fluorophore release by fluorescence spectrophotometry |
Bioorg Med Chem Lett 21: 6767-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.09.042
BindingDB Entry DOI: 10.7270/Q2G44T34 |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
Histone deacetylase
(Homo sapiens (Human)) | BDBM50484360
(CHEMBL1910047)Show SMILES Cc1cc(cc2ccccc12)S(=O)(=O)N1CCC(CCCC(=O)NO)CC1 Show InChI InChI=1S/C20H26N2O4S/c1-15-13-18(14-17-6-2-3-7-19(15)17)27(25,26)22-11-9-16(10-12-22)5-4-8-20(23)21-24/h2-3,6-7,13-14,16,24H,4-5,8-12H2,1H3,(H,21,23) | PDB
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UniProtKB/SwissProt
B.MOAD
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antibodypedia
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GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 124 | n/a | n/a | n/a | n/a | n/a | n/a |
Menarini Ricerche Pomezia
Curated by ChEMBL
| Assay Description
Inhibition of HDAC in human HeLa cell extract assessed as fluorophore release by fluorescence spectrophotometry |
Bioorg Med Chem Lett 21: 6767-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.09.042
BindingDB Entry DOI: 10.7270/Q2G44T34 |
More data for this
Ligand-Target Pair | |
Histone deacetylase
(Homo sapiens (Human)) | BDBM50484361
(CHEMBL1910049)Show SMILES ONC(=O)CCCC1CCN(CC1)S(=O)(=O)c1ccc2ccccc2c1 Show InChI InChI=1S/C19H24N2O4S/c22-19(20-23)7-3-4-15-10-12-21(13-11-15)26(24,25)18-9-8-16-5-1-2-6-17(16)14-18/h1-2,5-6,8-9,14-15,23H,3-4,7,10-13H2,(H,20,22) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 128 | n/a | n/a | n/a | n/a | n/a | n/a |
Menarini Ricerche Pomezia
Curated by ChEMBL
| Assay Description
Inhibition of HDAC in human HeLa cell extract assessed as fluorophore release by fluorescence spectrophotometry |
Bioorg Med Chem Lett 21: 6767-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.09.042
BindingDB Entry DOI: 10.7270/Q2G44T34 |
More data for this
Ligand-Target Pair | |
Histone deacetylase
(Homo sapiens (Human)) | BDBM50484357
(CHEMBL1909951)Show InChI InChI=1S/C15H21ClN2O4S/c16-13-5-1-2-6-14(13)23(21,22)18-10-8-12(9-11-18)4-3-7-15(19)17-20/h1-2,5-6,12,20H,3-4,7-11H2,(H,17,19) | PDB
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antibodypedia
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 173 | n/a | n/a | n/a | n/a | n/a | n/a |
Menarini Ricerche Pomezia
Curated by ChEMBL
| Assay Description
Inhibition of HDAC in human HeLa cell extract assessed as fluorophore release by fluorescence spectrophotometry |
Bioorg Med Chem Lett 21: 6767-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.09.042
BindingDB Entry DOI: 10.7270/Q2G44T34 |
More data for this
Ligand-Target Pair | |
Histone deacetylase
(Homo sapiens (Human)) | BDBM50484362
(CHEMBL1910050)Show SMILES ONC(=O)CCCC1CCN(CC1)S(=O)(=O)c1cccc2ccccc12 Show InChI InChI=1S/C19H24N2O4S/c22-19(20-23)10-3-5-15-11-13-21(14-12-15)26(24,25)18-9-4-7-16-6-1-2-8-17(16)18/h1-2,4,6-9,15,23H,3,5,10-14H2,(H,20,22) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
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antibodypedia
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antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 181 | n/a | n/a | n/a | n/a | n/a | n/a |
Menarini Ricerche Pomezia
Curated by ChEMBL
| Assay Description
Inhibition of HDAC in human HeLa cell extract assessed as fluorophore release by fluorescence spectrophotometry |
Bioorg Med Chem Lett 21: 6767-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.09.042
BindingDB Entry DOI: 10.7270/Q2G44T34 |
More data for this
Ligand-Target Pair | |
Histone deacetylase
(Homo sapiens (Human)) | BDBM50484359
(CHEMBL1910042)Show SMILES ONC(=O)CCCC1CCN(CC1)S(=O)(=O)c1cccc(c1)-c1cnco1 Show InChI InChI=1S/C18H23N3O5S/c22-18(20-23)6-1-3-14-7-9-21(10-8-14)27(24,25)16-5-2-4-15(11-16)17-12-19-13-26-17/h2,4-5,11-14,23H,1,3,6-10H2,(H,20,22) | PDB
KEGG
UniProtKB/SwissProt
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antibodypedia
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 213 | n/a | n/a | n/a | n/a | n/a | n/a |
Menarini Ricerche Pomezia
Curated by ChEMBL
| Assay Description
Inhibition of HDAC in human HeLa cell extract assessed as fluorophore release by fluorescence spectrophotometry |
Bioorg Med Chem Lett 21: 6767-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.09.042
BindingDB Entry DOI: 10.7270/Q2G44T34 |
More data for this
Ligand-Target Pair | |
Histone deacetylase
(Homo sapiens (Human)) | BDBM50484363
(CHEMBL1909955)Show SMILES COc1ccc(cc1OC)S(=O)(=O)N1CCC(CCCC(=O)NO)CC1 Show InChI InChI=1S/C17H26N2O6S/c1-24-15-7-6-14(12-16(15)25-2)26(22,23)19-10-8-13(9-11-19)4-3-5-17(20)18-21/h6-7,12-13,21H,3-5,8-11H2,1-2H3,(H,18,20) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
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antibodypedia
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antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 317 | n/a | n/a | n/a | n/a | n/a | n/a |
Menarini Ricerche Pomezia
Curated by ChEMBL
| Assay Description
Inhibition of HDAC in human HeLa cell extract assessed as fluorophore release by fluorescence spectrophotometry |
Bioorg Med Chem Lett 21: 6767-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.09.042
BindingDB Entry DOI: 10.7270/Q2G44T34 |
More data for this
Ligand-Target Pair | |
Histone deacetylase
(Homo sapiens (Human)) | BDBM50484358
(CHEMBL1909943)Show SMILES CC(C)c1ccc(cc1)S(=O)(=O)N1CCC(CCCC(=O)NO)CC1 Show InChI InChI=1S/C18H28N2O4S/c1-14(2)16-6-8-17(9-7-16)25(23,24)20-12-10-15(11-13-20)4-3-5-18(21)19-22/h6-9,14-15,22H,3-5,10-13H2,1-2H3,(H,19,21) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 537 | n/a | n/a | n/a | n/a | n/a | n/a |
Menarini Ricerche Pomezia
Curated by ChEMBL
| Assay Description
Inhibition of HDAC in human HeLa cell extract assessed as fluorophore release by fluorescence spectrophotometry |
Bioorg Med Chem Lett 21: 6767-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.09.042
BindingDB Entry DOI: 10.7270/Q2G44T34 |
More data for this
Ligand-Target Pair | |
Histone deacetylase
(Homo sapiens (Human)) | BDBM50483615
(CHEMBL1760911)Show InChI InChI=1S/C15H22N2O4S/c18-15(16-19)8-4-5-13-9-11-17(12-10-13)22(20,21)14-6-2-1-3-7-14/h1-3,6-7,13,19H,4-5,8-12H2,(H,16,18) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 540 | n/a | n/a | n/a | n/a | n/a | n/a |
Menarini Ricerche Pomezia
Curated by ChEMBL
| Assay Description
Inhibition of HDAC in human HeLa cell extract assessed as fluorophore release by fluorescence spectrophotometry |
Bioorg Med Chem Lett 21: 6767-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.09.042
BindingDB Entry DOI: 10.7270/Q2G44T34 |
More data for this
Ligand-Target Pair | |
Histone deacetylase
(Homo sapiens (Human)) | BDBM50483614
(CHEMBL1760910)Show InChI InChI=1S/C16H24N2O4S/c19-16(17-20)8-4-7-14-9-11-18(12-10-14)23(21,22)13-15-5-2-1-3-6-15/h1-3,5-6,14,20H,4,7-13H2,(H,17,19) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 840 | n/a | n/a | n/a | n/a | n/a | n/a |
Menarini Ricerche Pomezia
Curated by ChEMBL
| Assay Description
Inhibition of HDAC in human HeLa cell extract assessed as fluorophore release by fluorescence spectrophotometry |
Bioorg Med Chem Lett 21: 6767-9 (2011)
Article DOI: 10.1016/j.bmcl.2011.09.042
BindingDB Entry DOI: 10.7270/Q2G44T34 |
More data for this
Ligand-Target Pair | |
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