Found 80 hits of Enzyme Inhibition Constant Data 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 1
(Homo sapiens (Human)) | BDBM50102537
(CHEMBL3339026)Show SMILES Cc1ccc(Nc2ncnc3sc(NC(=O)CCCCCCC(=O)NO)cc23)cc1C Show InChI InChI=1S/C22H27N5O3S/c1-14-9-10-16(11-15(14)2)25-21-17-12-20(31-22(17)24-13-23-21)26-18(28)7-5-3-4-6-8-19(29)27-30/h9-13,30H,3-8H2,1-2H3,(H,26,28)(H,27,29)(H,23,24,25) | 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 | 1.10 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC1 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 6
(Homo sapiens (Human)) | BDBM50102566
(CHEMBL3339030)Show SMILES ONC(=O)CCCCCCC(=O)Nc1cc2c(Nc3ccc(O[C@H]4CCOC4)c(Cl)c3)ncnc2s1 |r| Show InChI InChI=1S/C24H28ClN5O5S/c25-18-11-15(7-8-19(18)35-16-9-10-34-13-16)28-23-17-12-22(36-24(17)27-14-26-23)29-20(31)5-3-1-2-4-6-21(32)30-33/h7-8,11-12,14,16,33H,1-6,9-10,13H2,(H,29,31)(H,30,32)(H,26,27,28)/t16-/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 | 1.90 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC6 using (Boc-Lys (-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50102498
(CHEMBL3339022)Show SMILES ONC(=O)CCCCCCC(=O)Nc1cc2c(Nc3ccccc3)ncnc2s1 Show InChI InChI=1S/C20H23N5O3S/c26-16(10-6-1-2-7-11-17(27)25-28)24-18-12-15-19(21-13-22-20(15)29-18)23-14-8-4-3-5-9-14/h3-5,8-9,12-13,28H,1-2,6-7,10-11H2,(H,24,26)(H,25,27)(H,21,22,23) | 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 | 1.90 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC1 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50102539
(CHEMBL3339024)Show SMILES Cc1ccc(Nc2ncnc3sc(NC(=O)CCCCCCC(=O)NO)cc23)cc1 Show InChI InChI=1S/C21H25N5O3S/c1-14-8-10-15(11-9-14)24-20-16-12-19(30-21(16)23-13-22-20)25-17(27)6-4-2-3-5-7-18(28)26-29/h8-13,29H,2-7H2,1H3,(H,25,27)(H,26,28)(H,22,23,24) | 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 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC1 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 6
(Homo sapiens (Human)) | BDBM50102534
(CHEMBL3339029)Show SMILES CN(C)c1ccc(Nc2ncnc3sc(NC(=O)CCCCCCC(=O)NO)cc23)cc1F Show InChI InChI=1S/C22H27FN6O3S/c1-29(2)17-10-9-14(11-16(17)23)26-21-15-12-20(33-22(15)25-13-24-21)27-18(30)7-5-3-4-6-8-19(31)28-32/h9-13,32H,3-8H2,1-2H3,(H,27,30)(H,28,31)(H,24,25,26) | 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 | 2.70 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC6 using (Boc-Lys (-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 3
(Homo sapiens (Human)) | BDBM50102539
(CHEMBL3339024)Show SMILES Cc1ccc(Nc2ncnc3sc(NC(=O)CCCCCCC(=O)NO)cc23)cc1 Show InChI InChI=1S/C21H25N5O3S/c1-14-8-10-15(11-9-14)24-20-16-12-19(30-21(16)23-13-22-20)25-17(27)6-4-2-3-5-7-18(28)26-29/h8-13,29H,2-7H2,1H3,(H,25,27)(H,26,28)(H,22,23,24) | 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 | 2.90 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC3 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50102566
(CHEMBL3339030)Show SMILES ONC(=O)CCCCCCC(=O)Nc1cc2c(Nc3ccc(O[C@H]4CCOC4)c(Cl)c3)ncnc2s1 |r| Show InChI InChI=1S/C24H28ClN5O5S/c25-18-11-15(7-8-19(18)35-16-9-10-34-13-16)28-23-17-12-22(36-24(17)27-14-26-23)29-20(31)5-3-1-2-4-6-21(32)30-33/h7-8,11-12,14,16,33H,1-6,9-10,13H2,(H,29,31)(H,30,32)(H,26,27,28)/t16-/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 | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC1 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 3
(Homo sapiens (Human)) | BDBM50102534
(CHEMBL3339029)Show SMILES CN(C)c1ccc(Nc2ncnc3sc(NC(=O)CCCCCCC(=O)NO)cc23)cc1F Show InChI InChI=1S/C22H27FN6O3S/c1-29(2)17-10-9-14(11-16(17)23)26-21-15-12-20(33-22(15)25-13-24-21)27-18(30)7-5-3-4-6-8-19(31)28-32/h9-13,32H,3-8H2,1-2H3,(H,27,30)(H,28,31)(H,24,25,26) | PDB
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 | 3.20 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC3 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50102532
(CHEMBL3339020)Show SMILES ONC(=O)CCCCCCC(=O)Nc1cc2c(Nc3cccc(Cl)c3)ncnc2s1 Show InChI InChI=1S/C20H22ClN5O3S/c21-13-6-5-7-14(10-13)24-19-15-11-18(30-20(15)23-12-22-19)25-16(27)8-3-1-2-4-9-17(28)26-29/h5-7,10-12,29H,1-4,8-9H2,(H,25,27)(H,26,28)(H,22,23,24) | 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 | 3.20 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC1 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 6
(Homo sapiens (Human)) | BDBM50102546
(CHEMBL3339031)Show SMILES ONC(=O)CCCCCCC(=O)Nc1cc2c(Nc3ccc(N4CCCCC4)c(F)c3)ncnc2s1 Show InChI InChI=1S/C25H31FN6O3S/c26-19-14-17(10-11-20(19)32-12-6-3-7-13-32)29-24-18-15-23(36-25(18)28-16-27-24)30-21(33)8-4-1-2-5-9-22(34)31-35/h10-11,14-16,35H,1-9,12-13H2,(H,30,33)(H,31,34)(H,27,28,29) | 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 | 3.40 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC6 using (Boc-Lys (-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 6
(Homo sapiens (Human)) | BDBM50102535
(CHEMBL3339028)Show SMILES CCN(CC)c1ccc(Nc2ncnc3sc(NC(=O)CCCCCCC(=O)NO)cc23)cc1F Show InChI InChI=1S/C24H31FN6O3S/c1-3-31(4-2)19-12-11-16(13-18(19)25)28-23-17-14-22(35-24(17)27-15-26-23)29-20(32)9-7-5-6-8-10-21(33)30-34/h11-15,34H,3-10H2,1-2H3,(H,29,32)(H,30,33)(H,26,27,28) | 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 | 3.40 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC6 using (Boc-Lys (-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 3
(Homo sapiens (Human)) | BDBM50102498
(CHEMBL3339022)Show SMILES ONC(=O)CCCCCCC(=O)Nc1cc2c(Nc3ccccc3)ncnc2s1 Show InChI InChI=1S/C20H23N5O3S/c26-16(10-6-1-2-7-11-17(27)25-28)24-18-12-15-19(21-13-22-20(15)29-18)23-14-8-4-3-5-9-14/h3-5,8-9,12-13,28H,1-2,6-7,10-11H2,(H,24,26)(H,25,27)(H,21,22,23) | PDB
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 | 3.5 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC3 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 3
(Homo sapiens (Human)) | BDBM50102535
(CHEMBL3339028)Show SMILES CCN(CC)c1ccc(Nc2ncnc3sc(NC(=O)CCCCCCC(=O)NO)cc23)cc1F Show InChI InChI=1S/C24H31FN6O3S/c1-3-31(4-2)19-12-11-16(13-18(19)25)28-23-17-14-22(35-24(17)27-15-26-23)29-20(32)9-7-5-6-8-10-21(33)30-34/h11-15,34H,3-10H2,1-2H3,(H,29,32)(H,30,33)(H,26,27,28) | PDB
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 | 3.5 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC3 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 3
(Homo sapiens (Human)) | BDBM50102537
(CHEMBL3339026)Show SMILES Cc1ccc(Nc2ncnc3sc(NC(=O)CCCCCCC(=O)NO)cc23)cc1C Show InChI InChI=1S/C22H27N5O3S/c1-14-9-10-16(11-15(14)2)25-21-17-12-20(31-22(17)24-13-23-21)26-18(28)7-5-3-4-6-8-19(29)27-30/h9-13,30H,3-8H2,1-2H3,(H,26,28)(H,27,29)(H,23,24,25) | PDB
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 | 3.60 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC3 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 3
(Homo sapiens (Human)) | BDBM50102566
(CHEMBL3339030)Show SMILES ONC(=O)CCCCCCC(=O)Nc1cc2c(Nc3ccc(O[C@H]4CCOC4)c(Cl)c3)ncnc2s1 |r| Show InChI InChI=1S/C24H28ClN5O5S/c25-18-11-15(7-8-19(18)35-16-9-10-34-13-16)28-23-17-12-22(36-24(17)27-14-26-23)29-20(31)5-3-1-2-4-6-21(32)30-33/h7-8,11-12,14,16,33H,1-6,9-10,13H2,(H,29,31)(H,30,32)(H,26,27,28)/t16-/m0/s1 | PDB
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 | 3.60 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC3 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50102534
(CHEMBL3339029)Show SMILES CN(C)c1ccc(Nc2ncnc3sc(NC(=O)CCCCCCC(=O)NO)cc23)cc1F Show InChI InChI=1S/C22H27FN6O3S/c1-29(2)17-10-9-14(11-16(17)23)26-21-15-12-20(33-22(15)25-13-24-21)27-18(30)7-5-3-4-6-8-19(31)28-32/h9-13,32H,3-8H2,1-2H3,(H,27,30)(H,28,31)(H,24,25,26) | 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 | 4.5 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC1 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50102535
(CHEMBL3339028)Show SMILES CCN(CC)c1ccc(Nc2ncnc3sc(NC(=O)CCCCCCC(=O)NO)cc23)cc1F Show InChI InChI=1S/C24H31FN6O3S/c1-3-31(4-2)19-12-11-16(13-18(19)25)28-23-17-14-22(35-24(17)27-15-26-23)29-20(32)9-7-5-6-8-10-21(33)30-34/h11-15,34H,3-10H2,1-2H3,(H,29,32)(H,30,33)(H,26,27,28) | 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 | 4.60 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC1 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 6
(Homo sapiens (Human)) | BDBM50102539
(CHEMBL3339024)Show SMILES Cc1ccc(Nc2ncnc3sc(NC(=O)CCCCCCC(=O)NO)cc23)cc1 Show InChI InChI=1S/C21H25N5O3S/c1-14-8-10-15(11-9-14)24-20-16-12-19(30-21(16)23-13-22-20)25-17(27)6-4-2-3-5-7-18(28)26-29/h8-13,29H,2-7H2,1H3,(H,25,27)(H,26,28)(H,22,23,24) | 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 | 5.40 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC6 using (Boc-Lys (-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50102546
(CHEMBL3339031)Show SMILES ONC(=O)CCCCCCC(=O)Nc1cc2c(Nc3ccc(N4CCCCC4)c(F)c3)ncnc2s1 Show InChI InChI=1S/C25H31FN6O3S/c26-19-14-17(10-11-20(19)32-12-6-3-7-13-32)29-24-18-15-23(36-25(18)28-16-27-24)30-21(33)8-4-1-2-5-9-22(34)31-35/h10-11,14-16,35H,1-9,12-13H2,(H,30,33)(H,31,34)(H,27,28,29) | 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 | 5.40 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC1 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 6
(Homo sapiens (Human)) | BDBM50102493
(CHEMBL3339016)Show SMILES ONC(=O)CCCCCCC(=O)Nc1cc2c(Nc3ccc(Cl)cc3F)ncnc2s1 Show InChI InChI=1S/C20H21ClFN5O3S/c21-12-7-8-15(14(22)9-12)25-19-13-10-18(31-20(13)24-11-23-19)26-16(28)5-3-1-2-4-6-17(29)27-30/h7-11,30H,1-6H2,(H,26,28)(H,27,29)(H,23,24,25) | 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 | 5.60 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC6 using (Boc-Lys (-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50102491
(CHEMBL3339018)Show SMILES ONC(=O)CCCCCCC(=O)Nc1cc2c(Nc3ccc(I)cc3F)ncnc2s1 Show InChI InChI=1S/C20H21FIN5O3S/c21-14-9-12(22)7-8-15(14)25-19-13-10-18(31-20(13)24-11-23-19)26-16(28)5-3-1-2-4-6-17(29)27-30/h7-11,30H,1-6H2,(H,26,28)(H,27,29)(H,23,24,25) | 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 | 6.20 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC1 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 3
(Homo sapiens (Human)) | BDBM50102532
(CHEMBL3339020)Show SMILES ONC(=O)CCCCCCC(=O)Nc1cc2c(Nc3cccc(Cl)c3)ncnc2s1 Show InChI InChI=1S/C20H22ClN5O3S/c21-13-6-5-7-14(10-13)24-19-15-11-18(30-20(15)23-12-22-19)25-16(27)8-3-1-2-4-9-17(28)26-29/h5-7,10-12,29H,1-4,8-9H2,(H,25,27)(H,26,28)(H,22,23,24) | PDB
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 | 6.5 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC3 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 6
(Homo sapiens (Human)) | BDBM50102491
(CHEMBL3339018)Show SMILES ONC(=O)CCCCCCC(=O)Nc1cc2c(Nc3ccc(I)cc3F)ncnc2s1 Show InChI InChI=1S/C20H21FIN5O3S/c21-14-9-12(22)7-8-15(14)25-19-13-10-18(31-20(13)24-11-23-19)26-16(28)5-3-1-2-4-6-17(29)27-30/h7-11,30H,1-6H2,(H,26,28)(H,27,29)(H,23,24,25) | 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 | 6.60 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC6 using (Boc-Lys (-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 6
(Homo sapiens (Human)) | BDBM50102542
(CHEMBL3339033)Show SMILES ONC(=O)CCCCCCC(=O)Nc1cc2c(Nc3ccc(cc3)N3CCCC3)ncnc2s1 Show InChI InChI=1S/C24H30N6O3S/c31-20(7-3-1-2-4-8-21(32)29-33)28-22-15-19-23(25-16-26-24(19)34-22)27-17-9-11-18(12-10-17)30-13-5-6-14-30/h9-12,15-16,33H,1-8,13-14H2,(H,28,31)(H,29,32)(H,25,26,27) | 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 | 7.20 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC6 using (Boc-Lys (-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50102533
(CHEMBL3339019)Show SMILES ONC(=O)CCCCCCC(=O)Nc1cc2c(Nc3cccc(Cl)c3F)ncnc2s1 Show InChI InChI=1S/C20H21ClFN5O3S/c21-13-6-5-7-14(18(13)22)25-19-12-10-17(31-20(12)24-11-23-19)26-15(28)8-3-1-2-4-9-16(29)27-30/h5-7,10-11,30H,1-4,8-9H2,(H,26,28)(H,27,29)(H,23,24,25) | 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 | 7.80 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC1 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 6
(Homo sapiens (Human)) | BDBM50102494
(CHEMBL3339015)Show SMILES ONC(=O)CCCCCCC(=O)Nc1cc2c(Nc3ccc(F)cc3F)ncnc2s1 Show InChI InChI=1S/C20H21F2N5O3S/c21-12-7-8-15(14(22)9-12)25-19-13-10-18(31-20(13)24-11-23-19)26-16(28)5-3-1-2-4-6-17(29)27-30/h7-11,30H,1-6H2,(H,26,28)(H,27,29)(H,23,24,25) | 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 | 7.90 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC6 using (Boc-Lys (-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 3
(Homo sapiens (Human)) | BDBM50102546
(CHEMBL3339031)Show SMILES ONC(=O)CCCCCCC(=O)Nc1cc2c(Nc3ccc(N4CCCCC4)c(F)c3)ncnc2s1 Show InChI InChI=1S/C25H31FN6O3S/c26-19-14-17(10-11-20(19)32-12-6-3-7-13-32)29-24-18-15-23(36-25(18)28-16-27-24)30-21(33)8-4-1-2-5-9-22(34)31-35/h10-11,14-16,35H,1-9,12-13H2,(H,30,33)(H,31,34)(H,27,28,29) | PDB
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 | 8.20 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC3 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 6
(Homo sapiens (Human)) | BDBM50102533
(CHEMBL3339019)Show SMILES ONC(=O)CCCCCCC(=O)Nc1cc2c(Nc3cccc(Cl)c3F)ncnc2s1 Show InChI InChI=1S/C20H21ClFN5O3S/c21-13-6-5-7-14(18(13)22)25-19-12-10-17(31-20(12)24-11-23-19)26-15(28)8-3-1-2-4-9-16(29)27-30/h5-7,10-11,30H,1-4,8-9H2,(H,26,28)(H,27,29)(H,23,24,25) | 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 | 8.5 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC6 using (Boc-Lys (-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 6
(Homo sapiens (Human)) | BDBM50102532
(CHEMBL3339020)Show SMILES ONC(=O)CCCCCCC(=O)Nc1cc2c(Nc3cccc(Cl)c3)ncnc2s1 Show InChI InChI=1S/C20H22ClN5O3S/c21-13-6-5-7-14(10-13)24-19-15-11-18(30-20(15)23-12-22-19)25-16(27)8-3-1-2-4-9-17(28)26-29/h5-7,10-12,29H,1-4,8-9H2,(H,25,27)(H,26,28)(H,22,23,24) | 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 | 8.60 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC6 using (Boc-Lys (-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 6
(Homo sapiens (Human)) | BDBM50102492
(CHEMBL3339017)Show SMILES ONC(=O)CCCCCCC(=O)Nc1cc2c(Nc3ccc(Br)cc3F)ncnc2s1 Show InChI InChI=1S/C20H21BrFN5O3S/c21-12-7-8-15(14(22)9-12)25-19-13-10-18(31-20(13)24-11-23-19)26-16(28)5-3-1-2-4-6-17(29)27-30/h7-11,30H,1-6H2,(H,26,28)(H,27,29)(H,23,24,25) | 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 | 8.90 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC6 using (Boc-Lys (-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 6
(Homo sapiens (Human)) | BDBM50102544
(CHEMBL3339032)Show SMILES ONC(=O)CCCCCCC(=O)Nc1cc2c(Nc3ccc(N4CCCC4)c(F)c3)ncnc2s1 Show InChI InChI=1S/C24H29FN6O3S/c25-18-13-16(9-10-19(18)31-11-5-6-12-31)28-23-17-14-22(35-24(17)27-15-26-23)29-20(32)7-3-1-2-4-8-21(33)30-34/h9-10,13-15,34H,1-8,11-12H2,(H,29,32)(H,30,33)(H,26,27,28) | 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 | 9.30 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC6 using (Boc-Lys (-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 3
(Homo sapiens (Human)) | BDBM50102497
(CHEMBL3339023)Show SMILES Cc1ccc(Nc2ncnc3sc(NC(=O)CCCCCC(=O)NO)cc23)cc1 Show InChI InChI=1S/C20H23N5O3S/c1-13-7-9-14(10-8-13)23-19-15-11-18(29-20(15)22-12-21-19)24-16(26)5-3-2-4-6-17(27)25-28/h7-12,28H,2-6H2,1H3,(H,24,26)(H,25,27)(H,21,22,23) | PDB
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 | 9.30 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC3 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50102494
(CHEMBL3339015)Show SMILES ONC(=O)CCCCCCC(=O)Nc1cc2c(Nc3ccc(F)cc3F)ncnc2s1 Show InChI InChI=1S/C20H21F2N5O3S/c21-12-7-8-15(14(22)9-12)25-19-13-10-18(31-20(13)24-11-23-19)26-16(28)5-3-1-2-4-6-17(29)27-30/h7-11,30H,1-6H2,(H,26,28)(H,27,29)(H,23,24,25) | 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 | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC1 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 6
(Homo sapiens (Human)) | BDBM50102495
(CHEMBL3339014)Show SMILES ONC(=O)CCCCCCC(=O)Nc1cc2c(Nc3ccc(Cl)c(c3)C(F)(F)F)ncnc2s1 Show InChI InChI=1S/C21H21ClF3N5O3S/c22-15-8-7-12(9-14(15)21(23,24)25)28-19-13-10-18(34-20(13)27-11-26-19)29-16(31)5-3-1-2-4-6-17(32)30-33/h7-11,33H,1-6H2,(H,29,31)(H,30,32)(H,26,27,28) | 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 | 11 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC6 using (Boc-Lys (-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 6
(Homo sapiens (Human)) | BDBM50102537
(CHEMBL3339026)Show SMILES Cc1ccc(Nc2ncnc3sc(NC(=O)CCCCCCC(=O)NO)cc23)cc1C Show InChI InChI=1S/C22H27N5O3S/c1-14-9-10-16(11-15(14)2)25-21-17-12-20(31-22(17)24-13-23-21)26-18(28)7-5-3-4-6-8-19(29)27-30/h9-13,30H,3-8H2,1-2H3,(H,26,28)(H,27,29)(H,23,24,25) | 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 | 11 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC6 using (Boc-Lys (-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 6
(Homo sapiens (Human)) | BDBM50102498
(CHEMBL3339022)Show SMILES ONC(=O)CCCCCCC(=O)Nc1cc2c(Nc3ccccc3)ncnc2s1 Show InChI InChI=1S/C20H23N5O3S/c26-16(10-6-1-2-7-11-17(27)25-28)24-18-12-15-19(21-13-22-20(15)29-18)23-14-8-4-3-5-9-14/h3-5,8-9,12-13,28H,1-2,6-7,10-11H2,(H,24,26)(H,25,27)(H,21,22,23) | 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 | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC6 using (Boc-Lys (-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50102513
(CHEMBL3339021)Show InChI InChI=1S/C19H21N5O3S/c25-15(9-5-2-6-10-16(26)24-27)23-17-11-14-18(20-12-21-19(14)28-17)22-13-7-3-1-4-8-13/h1,3-4,7-8,11-12,27H,2,5-6,9-10H2,(H,23,25)(H,24,26)(H,20,21,22) | 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 | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC1 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 3
(Homo sapiens (Human)) | BDBM50102492
(CHEMBL3339017)Show SMILES ONC(=O)CCCCCCC(=O)Nc1cc2c(Nc3ccc(Br)cc3F)ncnc2s1 Show InChI InChI=1S/C20H21BrFN5O3S/c21-12-7-8-15(14(22)9-12)25-19-13-10-18(31-20(13)24-11-23-19)26-16(28)5-3-1-2-4-6-17(29)27-30/h7-11,30H,1-6H2,(H,26,28)(H,27,29)(H,23,24,25) | PDB
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 | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC3 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50102493
(CHEMBL3339016)Show SMILES ONC(=O)CCCCCCC(=O)Nc1cc2c(Nc3ccc(Cl)cc3F)ncnc2s1 Show InChI InChI=1S/C20H21ClFN5O3S/c21-12-7-8-15(14(22)9-12)25-19-13-10-18(31-20(13)24-11-23-19)26-16(28)5-3-1-2-4-6-17(29)27-30/h7-11,30H,1-6H2,(H,26,28)(H,27,29)(H,23,24,25) | 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 | 13 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC1 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50102543
(CHEMBL3339011)Show SMILES ONC(=O)CCCCCCC(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)ncnc2s1 Show InChI InChI=1S/C20H21ClFN5O3S/c21-14-9-12(7-8-15(14)22)25-19-13-10-18(31-20(13)24-11-23-19)26-16(28)5-3-1-2-4-6-17(29)27-30/h7-11,30H,1-6H2,(H,26,28)(H,27,29)(H,23,24,25) | 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 | 13 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC1 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 3
(Homo sapiens (Human)) | BDBM50102544
(CHEMBL3339032)Show SMILES ONC(=O)CCCCCCC(=O)Nc1cc2c(Nc3ccc(N4CCCC4)c(F)c3)ncnc2s1 Show InChI InChI=1S/C24H29FN6O3S/c25-18-13-16(9-10-19(18)31-11-5-6-12-31)28-23-17-14-22(35-24(17)27-15-26-23)29-20(32)7-3-1-2-4-8-21(33)30-34/h9-10,13-15,34H,1-8,11-12H2,(H,29,32)(H,30,33)(H,26,27,28) | PDB
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 |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC3 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 3
(Homo sapiens (Human)) | BDBM50102491
(CHEMBL3339018)Show SMILES ONC(=O)CCCCCCC(=O)Nc1cc2c(Nc3ccc(I)cc3F)ncnc2s1 Show InChI InChI=1S/C20H21FIN5O3S/c21-14-9-12(22)7-8-15(14)25-19-13-10-18(31-20(13)24-11-23-19)26-16(28)5-3-1-2-4-6-17(29)27-30/h7-11,30H,1-6H2,(H,26,28)(H,27,29)(H,23,24,25) | PDB
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 |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC3 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50102492
(CHEMBL3339017)Show SMILES ONC(=O)CCCCCCC(=O)Nc1cc2c(Nc3ccc(Br)cc3F)ncnc2s1 Show InChI InChI=1S/C20H21BrFN5O3S/c21-12-7-8-15(14(22)9-12)25-19-13-10-18(31-20(13)24-11-23-19)26-16(28)5-3-1-2-4-6-17(29)27-30/h7-11,30H,1-6H2,(H,26,28)(H,27,29)(H,23,24,25) | 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 | 14 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC1 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50102542
(CHEMBL3339033)Show SMILES ONC(=O)CCCCCCC(=O)Nc1cc2c(Nc3ccc(cc3)N3CCCC3)ncnc2s1 Show InChI InChI=1S/C24H30N6O3S/c31-20(7-3-1-2-4-8-21(32)29-33)28-22-15-19-23(25-16-26-24(19)34-22)27-17-9-11-18(12-10-17)30-13-5-6-14-30/h9-12,15-16,33H,1-8,13-14H2,(H,28,31)(H,29,32)(H,25,26,27) | 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 | 14 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC1 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 3
(Homo sapiens (Human)) | BDBM50102542
(CHEMBL3339033)Show SMILES ONC(=O)CCCCCCC(=O)Nc1cc2c(Nc3ccc(cc3)N3CCCC3)ncnc2s1 Show InChI InChI=1S/C24H30N6O3S/c31-20(7-3-1-2-4-8-21(32)29-33)28-22-15-19-23(25-16-26-24(19)34-22)27-17-9-11-18(12-10-17)30-13-5-6-14-30/h9-12,15-16,33H,1-8,13-14H2,(H,28,31)(H,29,32)(H,25,26,27) | PDB
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 |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC3 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 3
(Homo sapiens (Human)) | BDBM50102493
(CHEMBL3339016)Show SMILES ONC(=O)CCCCCCC(=O)Nc1cc2c(Nc3ccc(Cl)cc3F)ncnc2s1 Show InChI InChI=1S/C20H21ClFN5O3S/c21-12-7-8-15(14(22)9-12)25-19-13-10-18(31-20(13)24-11-23-19)26-16(28)5-3-1-2-4-6-17(29)27-30/h7-11,30H,1-6H2,(H,26,28)(H,27,29)(H,23,24,25) | PDB
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 |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC3 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50102544
(CHEMBL3339032)Show SMILES ONC(=O)CCCCCCC(=O)Nc1cc2c(Nc3ccc(N4CCCC4)c(F)c3)ncnc2s1 Show InChI InChI=1S/C24H29FN6O3S/c25-18-13-16(9-10-19(18)31-11-5-6-12-31)28-23-17-14-22(35-24(17)27-15-26-23)29-20(32)7-3-1-2-4-8-21(33)30-34/h9-10,13-15,34H,1-8,11-12H2,(H,29,32)(H,30,33)(H,26,27,28) | 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 | 14 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC1 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50102497
(CHEMBL3339023)Show SMILES Cc1ccc(Nc2ncnc3sc(NC(=O)CCCCCC(=O)NO)cc23)cc1 Show InChI InChI=1S/C20H23N5O3S/c1-13-7-9-14(10-8-13)23-19-15-11-18(29-20(15)22-12-21-19)24-16(26)5-3-2-4-6-17(27)25-28/h7-12,28H,2-6H2,1H3,(H,24,26)(H,25,27)(H,21,22,23) | 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 | 14 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC1 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 3
(Homo sapiens (Human)) | BDBM50102533
(CHEMBL3339019)Show SMILES ONC(=O)CCCCCCC(=O)Nc1cc2c(Nc3cccc(Cl)c3F)ncnc2s1 Show InChI InChI=1S/C20H21ClFN5O3S/c21-13-6-5-7-14(18(13)22)25-19-12-10-17(31-20(12)24-11-23-19)26-15(28)8-3-1-2-4-9-16(29)27-30/h5-7,10-11,30H,1-4,8-9H2,(H,26,28)(H,27,29)(H,23,24,25) | PDB
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 |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC3 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 6
(Homo sapiens (Human)) | BDBM50102496
(CHEMBL3339034)Show InChI InChI=1S/C14H17ClN4O3S/c15-13-9-7-12(23-14(9)17-8-16-13)18-10(20)5-3-1-2-4-6-11(21)19-22/h7-8,22H,1-6H2,(H,18,20)(H,19,21) | 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 |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC6 using (Boc-Lys (-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 3
(Homo sapiens (Human)) | BDBM50102538
(CHEMBL3339025)Show SMILES Cc1ccc(Nc2ncnc3sc(NC(=O)CCCCCC(=O)NO)cc23)cc1C Show InChI InChI=1S/C21H25N5O3S/c1-13-8-9-15(10-14(13)2)24-20-16-11-19(30-21(16)23-12-22-20)25-17(27)6-4-3-5-7-18(28)26-29/h8-12,29H,3-7H2,1-2H3,(H,25,27)(H,26,28)(H,22,23,24) | PDB
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 |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC3 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 3
(Homo sapiens (Human)) | BDBM50102494
(CHEMBL3339015)Show SMILES ONC(=O)CCCCCCC(=O)Nc1cc2c(Nc3ccc(F)cc3F)ncnc2s1 Show InChI InChI=1S/C20H21F2N5O3S/c21-12-7-8-15(14(22)9-12)25-19-13-10-18(31-20(13)24-11-23-19)26-16(28)5-3-1-2-4-6-17(29)27-30/h7-11,30H,1-6H2,(H,26,28)(H,27,29)(H,23,24,25) | PDB
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 | 17 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC3 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 6
(Homo sapiens (Human)) | BDBM50102538
(CHEMBL3339025)Show SMILES Cc1ccc(Nc2ncnc3sc(NC(=O)CCCCCC(=O)NO)cc23)cc1C Show InChI InChI=1S/C21H25N5O3S/c1-13-8-9-15(10-14(13)2)24-20-16-11-19(30-21(16)23-12-22-20)25-17(27)6-4-3-5-7-18(28)26-29/h8-12,29H,3-7H2,1-2H3,(H,25,27)(H,26,28)(H,22,23,24) | 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 | 17 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC6 using (Boc-Lys (-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 3
(Homo sapiens (Human)) | BDBM50102543
(CHEMBL3339011)Show SMILES ONC(=O)CCCCCCC(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)ncnc2s1 Show InChI InChI=1S/C20H21ClFN5O3S/c21-14-9-12(7-8-15(14)22)25-19-13-10-18(31-20(13)24-11-23-19)26-16(28)5-3-1-2-4-6-17(29)27-30/h7-11,30H,1-6H2,(H,26,28)(H,27,29)(H,23,24,25) | PDB
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 |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC3 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 6
(Homo sapiens (Human)) | BDBM50102497
(CHEMBL3339023)Show SMILES Cc1ccc(Nc2ncnc3sc(NC(=O)CCCCCC(=O)NO)cc23)cc1 Show InChI InChI=1S/C20H23N5O3S/c1-13-7-9-14(10-8-13)23-19-15-11-18(29-20(15)22-12-21-19)24-16(26)5-3-2-4-6-17(27)25-28/h7-12,28H,2-6H2,1H3,(H,24,26)(H,25,27)(H,21,22,23) | 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 | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC6 using (Boc-Lys (-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 3
(Homo sapiens (Human)) | BDBM50102513
(CHEMBL3339021)Show InChI InChI=1S/C19H21N5O3S/c25-15(9-5-2-6-10-16(26)24-27)23-17-11-14-18(20-12-21-19(14)28-17)22-13-7-3-1-4-8-13/h1,3-4,7-8,11-12,27H,2,5-6,9-10H2,(H,23,25)(H,24,26)(H,20,21,22) | PDB
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 | 21 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC3 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50102495
(CHEMBL3339014)Show SMILES ONC(=O)CCCCCCC(=O)Nc1cc2c(Nc3ccc(Cl)c(c3)C(F)(F)F)ncnc2s1 Show InChI InChI=1S/C21H21ClF3N5O3S/c22-15-8-7-12(9-14(15)21(23,24)25)28-19-13-10-18(34-20(13)27-11-26-19)29-16(31)5-3-1-2-4-6-17(32)30-33/h7-11,33H,1-6H2,(H,29,31)(H,30,32)(H,26,27,28) | 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 | 22 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC1 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 6
(Homo sapiens (Human)) | BDBM50102543
(CHEMBL3339011)Show SMILES ONC(=O)CCCCCCC(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)ncnc2s1 Show InChI InChI=1S/C20H21ClFN5O3S/c21-14-9-12(7-8-15(14)22)25-19-13-10-18(31-20(13)24-11-23-19)26-16(28)5-3-1-2-4-6-17(29)27-30/h7-11,30H,1-6H2,(H,26,28)(H,27,29)(H,23,24,25) | 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 | 22 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC6 using (Boc-Lys (-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 6
(Homo sapiens (Human)) | BDBM50102545
(CHEMBL3339010)Show SMILES ONC(=O)CCCCCC(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)ncnc2s1 Show InChI InChI=1S/C19H19ClFN5O3S/c20-13-8-11(6-7-14(13)21)24-18-12-9-17(30-19(12)23-10-22-18)25-15(27)4-2-1-3-5-16(28)26-29/h6-10,29H,1-5H2,(H,25,27)(H,26,28)(H,22,23,24) | 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 | 24 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC6 using (Boc-Lys (-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 3
(Homo sapiens (Human)) | BDBM50102495
(CHEMBL3339014)Show SMILES ONC(=O)CCCCCCC(=O)Nc1cc2c(Nc3ccc(Cl)c(c3)C(F)(F)F)ncnc2s1 Show InChI InChI=1S/C21H21ClF3N5O3S/c22-15-8-7-12(9-14(15)21(23,24)25)28-19-13-10-18(34-20(13)27-11-26-19)29-16(31)5-3-1-2-4-6-17(32)30-33/h7-11,33H,1-6H2,(H,29,31)(H,30,32)(H,26,27,28) | PDB
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 | 24 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC3 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50102496
(CHEMBL3339034)Show InChI InChI=1S/C14H17ClN4O3S/c15-13-9-7-12(23-14(9)17-8-16-13)18-10(20)5-3-1-2-4-6-11(21)19-22/h7-8,22H,1-6H2,(H,18,20)(H,19,21) | 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 | 26 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC1 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 6
(Homo sapiens (Human)) | BDBM50102513
(CHEMBL3339021)Show InChI InChI=1S/C19H21N5O3S/c25-15(9-5-2-6-10-16(26)24-27)23-17-11-14-18(20-12-21-19(14)28-17)22-13-7-3-1-4-8-13/h1,3-4,7-8,11-12,27H,2,5-6,9-10H2,(H,23,25)(H,24,26)(H,20,21,22) | 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 | 27 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC6 using (Boc-Lys (-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 3
(Homo sapiens (Human)) | BDBM50102496
(CHEMBL3339034)Show InChI InChI=1S/C14H17ClN4O3S/c15-13-9-7-12(23-14(9)17-8-16-13)18-10(20)5-3-1-2-4-6-11(21)19-22/h7-8,22H,1-6H2,(H,18,20)(H,19,21) | PDB
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 | 27 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC3 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 6
(Homo sapiens (Human)) | BDBM50102540
(CHEMBL3339013)Show SMILES ONC(=O)CCCCCC(=O)Nc1cc2c(Nc3ccc(Cl)c(c3)C(F)(F)F)ncnc2s1 Show InChI InChI=1S/C20H19ClF3N5O3S/c21-14-7-6-11(8-13(14)20(22,23)24)27-18-12-9-17(33-19(12)26-10-25-18)28-15(30)4-2-1-3-5-16(31)29-32/h6-10,32H,1-5H2,(H,28,30)(H,29,31)(H,25,26,27) | 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 | 30 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC6 using (Boc-Lys (-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50102538
(CHEMBL3339025)Show SMILES Cc1ccc(Nc2ncnc3sc(NC(=O)CCCCCC(=O)NO)cc23)cc1C Show InChI InChI=1S/C21H25N5O3S/c1-13-8-9-15(10-14(13)2)24-20-16-11-19(30-21(16)23-12-22-20)25-17(27)6-4-3-5-7-18(28)26-29/h8-12,29H,3-7H2,1-2H3,(H,25,27)(H,26,28)(H,22,23,24) | 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 | 30 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC1 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50102536
(CHEMBL3339027)Show SMILES CCN(CC)c1ccc(Nc2ncnc3sc(NC(=O)CCCCCCC(=O)NO)cc23)cc1 Show InChI InChI=1S/C24H32N6O3S/c1-3-30(4-2)18-13-11-17(12-14-18)27-23-19-15-22(34-24(19)26-16-25-23)28-20(31)9-7-5-6-8-10-21(32)29-33/h11-16,33H,3-10H2,1-2H3,(H,28,31)(H,29,32)(H,25,26,27) | 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 | 33 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC1 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50102545
(CHEMBL3339010)Show SMILES ONC(=O)CCCCCC(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)ncnc2s1 Show InChI InChI=1S/C19H19ClFN5O3S/c20-13-8-11(6-7-14(13)21)24-18-12-9-17(30-19(12)23-10-22-18)25-15(27)4-2-1-3-5-16(28)26-29/h6-10,29H,1-5H2,(H,25,27)(H,26,28)(H,22,23,24) | 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 | 36 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC1 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 3
(Homo sapiens (Human)) | BDBM50102545
(CHEMBL3339010)Show SMILES ONC(=O)CCCCCC(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)ncnc2s1 Show InChI InChI=1S/C19H19ClFN5O3S/c20-13-8-11(6-7-14(13)21)24-18-12-9-17(30-19(12)23-10-22-18)25-15(27)4-2-1-3-5-16(28)26-29/h6-10,29H,1-5H2,(H,25,27)(H,26,28)(H,22,23,24) | PDB
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 | 38 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC3 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 3
(Homo sapiens (Human)) | BDBM50102536
(CHEMBL3339027)Show SMILES CCN(CC)c1ccc(Nc2ncnc3sc(NC(=O)CCCCCCC(=O)NO)cc23)cc1 Show InChI InChI=1S/C24H32N6O3S/c1-3-30(4-2)18-13-11-17(12-14-18)27-23-19-15-22(34-24(19)26-16-25-23)28-20(31)9-7-5-6-8-10-21(32)29-33/h11-16,33H,3-10H2,1-2H3,(H,28,31)(H,29,32)(H,25,26,27) | PDB
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 | 40 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC3 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50102540
(CHEMBL3339013)Show SMILES ONC(=O)CCCCCC(=O)Nc1cc2c(Nc3ccc(Cl)c(c3)C(F)(F)F)ncnc2s1 Show InChI InChI=1S/C20H19ClF3N5O3S/c21-14-7-6-11(8-13(14)20(22,23)24)27-18-12-9-17(33-19(12)26-10-25-18)28-15(30)4-2-1-3-5-16(31)29-32/h6-10,32H,1-5H2,(H,28,30)(H,29,31)(H,25,26,27) | 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 | 41 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC1 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 6
(Homo sapiens (Human)) | BDBM50102536
(CHEMBL3339027)Show SMILES CCN(CC)c1ccc(Nc2ncnc3sc(NC(=O)CCCCCCC(=O)NO)cc23)cc1 Show InChI InChI=1S/C24H32N6O3S/c1-3-30(4-2)18-13-11-17(12-14-18)27-23-19-15-22(34-24(19)26-16-25-23)28-20(31)9-7-5-6-8-10-21(32)29-33/h11-16,33H,3-10H2,1-2H3,(H,28,31)(H,29,32)(H,25,26,27) | 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 | 43 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC6 using (Boc-Lys (-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 3
(Homo sapiens (Human)) | BDBM50102540
(CHEMBL3339013)Show SMILES ONC(=O)CCCCCC(=O)Nc1cc2c(Nc3ccc(Cl)c(c3)C(F)(F)F)ncnc2s1 Show InChI InChI=1S/C20H19ClF3N5O3S/c21-14-7-6-11(8-13(14)20(22,23)24)27-18-12-9-17(33-19(12)26-10-25-18)28-15(30)4-2-1-3-5-16(31)29-32/h6-10,32H,1-5H2,(H,28,30)(H,29,31)(H,25,26,27) | PDB
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 | 48 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC3 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 6
(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
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
Article
PubMed
| n/a | n/a | 79 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC6 using (Boc-Lys (-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(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
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 | 93 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC1 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
Histone deacetylase 3
(Homo sapiens (Human)) | BDBM50102547
(CHEMBL3339009)Show SMILES ONC(=O)CCCCC(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)ncnc2s1 Show InChI InChI=1S/C18H17ClFN5O3S/c19-12-7-10(5-6-13(12)20)23-17-11-8-16(29-18(11)22-9-21-17)24-14(26)3-1-2-4-15(27)25-28/h5-9,28H,1-4H2,(H,24,26)(H,25,27)(H,21,22,23) | PDB
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 | 127 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC3 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50102547
(CHEMBL3339009)Show SMILES ONC(=O)CCCCC(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)ncnc2s1 Show InChI InChI=1S/C18H17ClFN5O3S/c19-12-7-10(5-6-13(12)20)23-17-11-8-16(29-18(11)22-9-21-17)24-14(26)3-1-2-4-15(27)25-28/h5-9,28H,1-4H2,(H,24,26)(H,25,27)(H,21,22,23) | 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 | 131 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC1 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 3
(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
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
Article
PubMed
| n/a | n/a | 158 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC3 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50102541
(CHEMBL3339012)Show SMILES ONC(=O)CCCCC(=O)Nc1cc2c(Nc3ccc(Cl)c(c3)C(F)(F)F)ncnc2s1 Show InChI InChI=1S/C19H17ClF3N5O3S/c20-13-6-5-10(7-12(13)19(21,22)23)26-17-11-8-16(32-18(11)25-9-24-17)27-14(29)3-1-2-4-15(30)28-31/h5-9,31H,1-4H2,(H,27,29)(H,28,30)(H,24,25,26) | 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 | 218 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC1 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 6
(Homo sapiens (Human)) | BDBM50102547
(CHEMBL3339009)Show SMILES ONC(=O)CCCCC(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)ncnc2s1 Show InChI InChI=1S/C18H17ClFN5O3S/c19-12-7-10(5-6-13(12)20)23-17-11-8-16(29-18(11)22-9-21-17)24-14(26)3-1-2-4-15(27)25-28/h5-9,28H,1-4H2,(H,24,26)(H,25,27)(H,21,22,23) | 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 | 569 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC6 using (Boc-Lys (-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 3
(Homo sapiens (Human)) | BDBM50102541
(CHEMBL3339012)Show SMILES ONC(=O)CCCCC(=O)Nc1cc2c(Nc3ccc(Cl)c(c3)C(F)(F)F)ncnc2s1 Show InChI InChI=1S/C19H17ClF3N5O3S/c20-13-6-5-10(7-12(13)19(21,22)23)26-17-11-8-16(32-18(11)25-9-24-17)27-14(29)3-1-2-4-15(30)28-31/h5-9,31H,1-4H2,(H,27,29)(H,28,30)(H,24,25,26) | PDB
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 | 607 | n/a | n/a | n/a | n/a | n/a | n/a |
The Walter and Eliza Hall Institute of Medical Research
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant full length HDAC3 using (Ac)-Lys-Tyr-Lys(-acetyl)-AMC substrate after 30 mins |
Bioorg Med Chem 22: 6146-55 (2014)
Article DOI: 10.1016/j.bmc.2014.08.030
BindingDB Entry DOI: 10.7270/Q2VQ34F7 |
More data for this
Ligand-Target Pair | |
Search and Browse
