Found 11 hits Enz. Inhib. hit(s) with all data for entry = 50032896 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 6
(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
| PDB Article PubMed
| n/a | n/a | 600 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of HDAC6 by fluorescence assay |
Bioorg Med Chem Lett 21: 1218-21 (2011)
Article DOI: 10.1016/j.bmcl.2010.12.079 BindingDB Entry DOI: 10.7270/Q28K79C8 |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Histone deacetylase 6
(Homo sapiens (Human)) | BDBM50336342
(CHEMBL1668018 | N-hydroxy-3-(1-(3-(naphthalen-2-yl...)Show SMILES ONC(=O)CCC1=CCN(CCCc2ccc3ccccc3c2)C1=O |t:6| Show InChI InChI=1S/C20H22N2O3/c23-19(21-25)10-9-17-11-13-22(20(17)24)12-3-4-15-7-8-16-5-1-2-6-18(16)14-15/h1-2,5-8,11,14,25H,3-4,9-10,12-13H2,(H,21,23) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
| Article PubMed
| n/a | n/a | 800 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of HDAC6 by fluorescence assay |
Bioorg Med Chem Lett 21: 1218-21 (2011)
Article DOI: 10.1016/j.bmcl.2010.12.079 BindingDB Entry DOI: 10.7270/Q28K79C8 |
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 | 3.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of HDAC1 by fluorescence assay |
Bioorg Med Chem Lett 21: 1218-21 (2011)
Article DOI: 10.1016/j.bmcl.2010.12.079 BindingDB Entry DOI: 10.7270/Q28K79C8 |
More data for this Ligand-Target Pair | |
Histone deacetylase 3
(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
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 | 5.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of HDAC3 by fluorescence assay |
Bioorg Med Chem Lett 21: 1218-21 (2011)
Article DOI: 10.1016/j.bmcl.2010.12.079 BindingDB Entry DOI: 10.7270/Q28K79C8 |
More data for this Ligand-Target Pair | |
Histone deacetylase 2
(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 | 7.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of HDAC2 by fluorescence assay |
Bioorg Med Chem Lett 21: 1218-21 (2011)
Article DOI: 10.1016/j.bmcl.2010.12.079 BindingDB Entry DOI: 10.7270/Q28K79C8 |
More data for this Ligand-Target Pair | |
Histone deacetylase 4
(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
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 | 7.69E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of HDAC4 by fluorescence assay |
Bioorg Med Chem Lett 21: 1218-21 (2011)
Article DOI: 10.1016/j.bmcl.2010.12.079 BindingDB Entry DOI: 10.7270/Q28K79C8 |
More data for this Ligand-Target Pair | |
Histone deacetylase 2
(Homo sapiens (Human)) | BDBM50336342
(CHEMBL1668018 | N-hydroxy-3-(1-(3-(naphthalen-2-yl...)Show SMILES ONC(=O)CCC1=CCN(CCCc2ccc3ccccc3c2)C1=O |t:6| Show InChI InChI=1S/C20H22N2O3/c23-19(21-25)10-9-17-11-13-22(20(17)24)12-3-4-15-7-8-16-5-1-2-6-18(16)14-15/h1-2,5-8,11,14,25H,3-4,9-10,12-13H2,(H,21,23) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
| Article PubMed
| n/a | n/a | 1.64E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of HDAC2 by fluorescence assay |
Bioorg Med Chem Lett 21: 1218-21 (2011)
Article DOI: 10.1016/j.bmcl.2010.12.079 BindingDB Entry DOI: 10.7270/Q28K79C8 |
More data for this Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50336342
(CHEMBL1668018 | N-hydroxy-3-(1-(3-(naphthalen-2-yl...)Show SMILES ONC(=O)CCC1=CCN(CCCc2ccc3ccccc3c2)C1=O |t:6| Show InChI InChI=1S/C20H22N2O3/c23-19(21-25)10-9-17-11-13-22(20(17)24)12-3-4-15-7-8-16-5-1-2-6-18(16)14-15/h1-2,5-8,11,14,25H,3-4,9-10,12-13H2,(H,21,23) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
| Article PubMed
| n/a | n/a | 2.56E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of HDAC1 by fluorescence assay |
Bioorg Med Chem Lett 21: 1218-21 (2011)
Article DOI: 10.1016/j.bmcl.2010.12.079 BindingDB Entry DOI: 10.7270/Q28K79C8 |
More data for this Ligand-Target Pair | |
Histone deacetylase 8
(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
| PDB Article PubMed
| n/a | n/a | 7.31E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of HDAC8 by fluorescence assay |
Bioorg Med Chem Lett 21: 1218-21 (2011)
Article DOI: 10.1016/j.bmcl.2010.12.079 BindingDB Entry DOI: 10.7270/Q28K79C8 |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Histone deacetylase 3
(Homo sapiens (Human)) | BDBM50336342
(CHEMBL1668018 | N-hydroxy-3-(1-(3-(naphthalen-2-yl...)Show SMILES ONC(=O)CCC1=CCN(CCCc2ccc3ccccc3c2)C1=O |t:6| Show InChI InChI=1S/C20H22N2O3/c23-19(21-25)10-9-17-11-13-22(20(17)24)12-3-4-15-7-8-16-5-1-2-6-18(16)14-15/h1-2,5-8,11,14,25H,3-4,9-10,12-13H2,(H,21,23) | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
| Article PubMed
| n/a | n/a | 8.01E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of HDAC3 by fluorescence assay |
Bioorg Med Chem Lett 21: 1218-21 (2011)
Article DOI: 10.1016/j.bmcl.2010.12.079 BindingDB Entry DOI: 10.7270/Q28K79C8 |
More data for this Ligand-Target Pair | |
Histone deacetylase 8
(Homo sapiens (Human)) | BDBM50336342
(CHEMBL1668018 | N-hydroxy-3-(1-(3-(naphthalen-2-yl...)Show SMILES ONC(=O)CCC1=CCN(CCCc2ccc3ccccc3c2)C1=O |t:6| Show InChI InChI=1S/C20H22N2O3/c23-19(21-25)10-9-17-11-13-22(20(17)24)12-3-4-15-7-8-16-5-1-2-6-18(16)14-15/h1-2,5-8,11,14,25H,3-4,9-10,12-13H2,(H,21,23) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
| Article PubMed
| n/a | n/a | 1.20E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of HDAC8 by fluorescence assay |
Bioorg Med Chem Lett 21: 1218-21 (2011)
Article DOI: 10.1016/j.bmcl.2010.12.079 BindingDB Entry DOI: 10.7270/Q28K79C8 |
More data for this Ligand-Target Pair | |