Found 30 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)) | BDBM50187081
(CHEMBL211624 | N-(2-aminophenyl)-4-((4-methoxyphen...)Show InChI InChI=1S/C21H21N3O2/c1-26-18-12-10-17(11-13-18)23-14-15-6-8-16(9-7-15)21(25)24-20-5-3-2-4-19(20)22/h2-13,23H,14,22H2,1H3,(H,24,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 600 | n/a | n/a | n/a | n/a | n/a | n/a |
MethylGene Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant HDAC1 |
Bioorg Med Chem Lett 16: 4048-52 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.005
BindingDB Entry DOI: 10.7270/Q2CF9PP5 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50187086
((E)-N-(2-aminophenyl)-3-(4-((3,4,5-trimethoxypheny...)Show SMILES COc1cc(NCc2ccc(\C=C\C(=O)Nc3ccccc3N)cc2)cc(OC)c1OC Show InChI InChI=1S/C25H27N3O4/c1-30-22-14-19(15-23(31-2)25(22)32-3)27-16-18-10-8-17(9-11-18)12-13-24(29)28-21-7-5-4-6-20(21)26/h4-15,27H,16,26H2,1-3H3,(H,28,29)/b13-12+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
MethylGene Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant HDAC1 |
Bioorg Med Chem Lett 16: 4048-52 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.005
BindingDB Entry DOI: 10.7270/Q2CF9PP5 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50187097
(3-(6-(4-methoxybenzylamino)pyridin-3-yl)-N-(2-amin...)Show SMILES COc1ccc(CNc2ccc(\C=C\C(=O)Nc3ccccc3N)cn2)cc1 Show InChI InChI=1S/C22H22N4O2/c1-28-18-10-6-16(7-11-18)14-24-21-12-8-17(15-25-21)9-13-22(27)26-20-5-3-2-4-19(20)23/h2-13,15H,14,23H2,1H3,(H,24,25)(H,26,27)/b13-9+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
MethylGene Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant HDAC1 |
Bioorg Med Chem Lett 16: 4048-52 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.005
BindingDB Entry DOI: 10.7270/Q2CF9PP5 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50187099
((E)-N-(2-aminophenyl)-3-(4-((3,4-dimethoxyphenylam...)Show SMILES COc1ccc(NCc2ccc(\C=C\C(=O)Nc3ccccc3N)cc2)cc1OC Show InChI InChI=1S/C24H25N3O3/c1-29-22-13-12-19(15-23(22)30-2)26-16-18-9-7-17(8-10-18)11-14-24(28)27-21-6-4-3-5-20(21)25/h3-15,26H,16,25H2,1-2H3,(H,27,28)/b14-11+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
MethylGene Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant HDAC1 |
Bioorg Med Chem Lett 16: 4048-52 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.005
BindingDB Entry DOI: 10.7270/Q2CF9PP5 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50187082
(CHEMBL425960 | N-(2-aminophenyl)-3-(6-(2-(phenylam...)Show InChI InChI=1S/C22H23N5O/c23-19-8-4-5-9-20(19)27-22(28)13-11-17-10-12-21(26-16-17)25-15-14-24-18-6-2-1-3-7-18/h1-13,16,24H,14-15,23H2,(H,25,26)(H,27,28)/b13-11+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
MethylGene Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant HDAC1 |
Bioorg Med Chem Lett 16: 4048-52 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.005
BindingDB Entry DOI: 10.7270/Q2CF9PP5 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50187090
(3-(6-(4-(trifluoromethoxy)benzylamino)pyridin-3-yl...)Show SMILES Nc1ccccc1NC(=O)\C=C\c1ccc(NCc2ccc(OC(F)(F)F)cc2)nc1 Show InChI InChI=1S/C22H19F3N4O2/c23-22(24,25)31-17-9-5-15(6-10-17)13-27-20-11-7-16(14-28-20)8-12-21(30)29-19-4-2-1-3-18(19)26/h1-12,14H,13,26H2,(H,27,28)(H,29,30)/b12-8+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
MethylGene Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant HDAC1 |
Bioorg Med Chem Lett 16: 4048-52 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.005
BindingDB Entry DOI: 10.7270/Q2CF9PP5 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM19413
(CHEMBL211625 | N-(2-aminophenyl)-4-{[(3,4-dimethox...)Show InChI InChI=1S/C22H23N3O3/c1-27-20-12-11-17(13-21(20)28-2)24-14-15-7-9-16(10-8-15)22(26)25-19-6-4-3-5-18(19)23/h3-13,24H,14,23H2,1-2H3,(H,25,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
MethylGene Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant HDAC1 |
Bioorg Med Chem Lett 16: 4048-52 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.005
BindingDB Entry DOI: 10.7270/Q2CF9PP5 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50187079
(4-(4-methoxybenzylamino)-N-(2-aminophenyl)benzamid...)Show InChI InChI=1S/C21H21N3O2/c1-26-18-12-6-15(7-13-18)14-23-17-10-8-16(9-11-17)21(25)24-20-5-3-2-4-19(20)22/h2-13,23H,14,22H2,1H3,(H,24,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
MethylGene Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant HDAC1 |
Bioorg Med Chem Lett 16: 4048-52 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.005
BindingDB Entry DOI: 10.7270/Q2CF9PP5 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50187104
(CHEMBL211395 | N-(2-aminophenyl)-4-((3,4,5-trimeth...)Show SMILES COc1cc(NCc2ccc(cc2)C(=O)Nc2ccccc2N)cc(OC)c1OC Show InChI InChI=1S/C23H25N3O4/c1-28-20-12-17(13-21(29-2)22(20)30-3)25-14-15-8-10-16(11-9-15)23(27)26-19-7-5-4-6-18(19)24/h4-13,25H,14,24H2,1-3H3,(H,26,27) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
MethylGene Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant HDAC1 |
Bioorg Med Chem Lett 16: 4048-52 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.005
BindingDB Entry DOI: 10.7270/Q2CF9PP5 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50187083
(6-(4-methoxyphenethylamino)-N-(2-aminophenyl)nicot...)Show InChI InChI=1S/C21H22N4O2/c1-27-17-9-6-15(7-10-17)12-13-23-20-11-8-16(14-24-20)21(26)25-19-5-3-2-4-18(19)22/h2-11,14H,12-13,22H2,1H3,(H,23,24)(H,25,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
MethylGene Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant HDAC1 |
Bioorg Med Chem Lett 16: 4048-52 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.005
BindingDB Entry DOI: 10.7270/Q2CF9PP5 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50187096
(CHEMBL214271 | N-(2-aminophenyl)-3-(6-((3,4,5-trim...)Show SMILES COc1cc(NCc2ccc(\C=C\C(=O)Nc3ccccc3N)cn2)cc(OC)c1OC Show InChI InChI=1S/C24H26N4O4/c1-30-21-12-18(13-22(31-2)24(21)32-3)27-15-17-10-8-16(14-26-17)9-11-23(29)28-20-7-5-4-6-19(20)25/h4-14,27H,15,25H2,1-3H3,(H,28,29)/b11-9+ | 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 | 3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
MethylGene Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant HDAC1 |
Bioorg Med Chem Lett 16: 4048-52 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.005
BindingDB Entry DOI: 10.7270/Q2CF9PP5 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50187092
((E)-N-(2-aminophenyl)-3-(4-((methyl(3,4,5-trimetho...)Show SMILES COc1cc(cc(OC)c1OC)N(C)Cc1ccc(\C=C\C(=O)Nc2ccccc2N)cc1 Show InChI InChI=1S/C26H29N3O4/c1-29(20-15-23(31-2)26(33-4)24(16-20)32-3)17-19-11-9-18(10-12-19)13-14-25(30)28-22-8-6-5-7-21(22)27/h5-16H,17,27H2,1-4H3,(H,28,30)/b14-13+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
MethylGene Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant HDAC1 |
Bioorg Med Chem Lett 16: 4048-52 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.005
BindingDB Entry DOI: 10.7270/Q2CF9PP5 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50187094
(CHEMBL375409 | N-(2-aminophenyl)-3-(6-(benzylamino...)Show InChI InChI=1S/C21H20N4O/c22-18-8-4-5-9-19(18)25-21(26)13-11-17-10-12-20(24-15-17)23-14-16-6-2-1-3-7-16/h1-13,15H,14,22H2,(H,23,24)(H,25,26)/b13-11+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
MethylGene Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant HDAC1 |
Bioorg Med Chem Lett 16: 4048-52 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.005
BindingDB Entry DOI: 10.7270/Q2CF9PP5 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50187102
(4-(3,4,5-trimethoxybenzylamino)-N-(2-aminophenyl)b...)Show SMILES COc1cc(CNc2ccc(cc2)C(=O)Nc2ccccc2N)cc(OC)c1OC Show InChI InChI=1S/C23H25N3O4/c1-28-20-12-15(13-21(29-2)22(20)30-3)14-25-17-10-8-16(9-11-17)23(27)26-19-7-5-4-6-18(19)24/h4-13,25H,14,24H2,1-3H3,(H,26,27) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
MethylGene Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant HDAC1 |
Bioorg Med Chem Lett 16: 4048-52 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.005
BindingDB Entry DOI: 10.7270/Q2CF9PP5 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50187078
(CHEMBL214153 | N-(2-aminophenyl)-3-(6-(3-phenylpro...)Show InChI InChI=1S/C23H24N4O/c24-20-10-4-5-11-21(20)27-23(28)15-13-19-12-14-22(26-17-19)25-16-6-9-18-7-2-1-3-8-18/h1-5,7-8,10-15,17H,6,9,16,24H2,(H,25,26)(H,27,28)/b15-13+ | 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 | 3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
MethylGene Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant HDAC1 |
Bioorg Med Chem Lett 16: 4048-52 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.005
BindingDB Entry DOI: 10.7270/Q2CF9PP5 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50187093
(3-(6-(4-(dimethylamino)benzylamino)pyridin-3-yl)-N...)Show SMILES CN(C)c1ccc(CNc2ccc(\C=C\C(=O)Nc3ccccc3N)cn2)cc1 Show InChI InChI=1S/C23H25N5O/c1-28(2)19-11-7-17(8-12-19)15-25-22-13-9-18(16-26-22)10-14-23(29)27-21-6-4-3-5-20(21)24/h3-14,16H,15,24H2,1-2H3,(H,25,26)(H,27,29)/b14-10+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
MethylGene Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant HDAC1 |
Bioorg Med Chem Lett 16: 4048-52 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.005
BindingDB Entry DOI: 10.7270/Q2CF9PP5 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50187084
(3-(6-(3,4,5-trimethoxybenzylamino)pyridin-3-yl)-N-...)Show SMILES COc1cc(CNc2ccc(\C=C\C(=O)Nc3ccccc3N)cn2)cc(OC)c1OC Show InChI InChI=1S/C24H26N4O4/c1-30-20-12-17(13-21(31-2)24(20)32-3)15-27-22-10-8-16(14-26-22)9-11-23(29)28-19-7-5-4-6-18(19)25/h4-14H,15,25H2,1-3H3,(H,26,27)(H,28,29)/b11-9+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
MethylGene Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant HDAC1 |
Bioorg Med Chem Lett 16: 4048-52 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.005
BindingDB Entry DOI: 10.7270/Q2CF9PP5 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50187077
((E)-N-(2-aminophenyl)-3-(4-((4-methoxyphenylamino)...)Show SMILES COc1ccc(NCc2ccc(\C=C\C(=O)Nc3ccccc3N)cc2)cc1 Show InChI InChI=1S/C23H23N3O2/c1-28-20-13-11-19(12-14-20)25-16-18-8-6-17(7-9-18)10-15-23(27)26-22-5-3-2-4-21(22)24/h2-15,25H,16,24H2,1H3,(H,26,27)/b15-10+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
MethylGene Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant HDAC1 |
Bioorg Med Chem Lett 16: 4048-52 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.005
BindingDB Entry DOI: 10.7270/Q2CF9PP5 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50187080
((E)-3-(4-(4-nitrobenzylamino)phenyl)-N-(2-aminophe...)Show SMILES Nc1ccccc1NC(=O)\C=C\c1ccc(NCc2ccc(cc2)[N+]([O-])=O)cc1 Show InChI InChI=1S/C22H20N4O3/c23-20-3-1-2-4-21(20)25-22(27)14-9-16-5-10-18(11-6-16)24-15-17-7-12-19(13-8-17)26(28)29/h1-14,24H,15,23H2,(H,25,27)/b14-9+ | 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 | 4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
MethylGene Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant HDAC1 |
Bioorg Med Chem Lett 16: 4048-52 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.005
BindingDB Entry DOI: 10.7270/Q2CF9PP5 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50187105
((E)-3-(4-(4-methoxybenzylamino)phenyl)-N-(2-aminop...)Show SMILES COc1ccc(CNc2ccc(\C=C\C(=O)Nc3ccccc3N)cc2)cc1 Show InChI InChI=1S/C23H23N3O2/c1-28-20-13-8-18(9-14-20)16-25-19-11-6-17(7-12-19)10-15-23(27)26-22-5-3-2-4-21(22)24/h2-15,25H,16,24H2,1H3,(H,26,27)/b15-10+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
MethylGene Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant HDAC1 |
Bioorg Med Chem Lett 16: 4048-52 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.005
BindingDB Entry DOI: 10.7270/Q2CF9PP5 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50187091
(CHEMBL378696 | N-(2-aminophenyl)-3-(6-(pyridin-4-y...)Show InChI InChI=1S/C20H19N5O/c21-17-3-1-2-4-18(17)25-20(26)8-6-15-5-7-19(23-13-15)24-14-16-9-11-22-12-10-16/h1-13H,14,21H2,(H,23,24)(H,25,26)/b8-6+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
MethylGene Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant HDAC1 |
Bioorg Med Chem Lett 16: 4048-52 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.005
BindingDB Entry DOI: 10.7270/Q2CF9PP5 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50187098
(4-(3,4-dimethoxybenzylamino)-N-(2-aminophenyl)benz...)Show InChI InChI=1S/C22H23N3O3/c1-27-20-12-7-15(13-21(20)28-2)14-24-17-10-8-16(9-11-17)22(26)25-19-6-4-3-5-18(19)23/h3-13,24H,14,23H2,1-2H3,(H,25,26) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
MethylGene Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant HDAC1 |
Bioorg Med Chem Lett 16: 4048-52 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.005
BindingDB Entry DOI: 10.7270/Q2CF9PP5 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50187085
(6-(4-methoxybenzylamino)-N-(2-aminophenyl)nicotina...)Show InChI InChI=1S/C20H20N4O2/c1-26-16-9-6-14(7-10-16)12-22-19-11-8-15(13-23-19)20(25)24-18-5-3-2-4-17(18)21/h2-11,13H,12,21H2,1H3,(H,22,23)(H,24,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
MethylGene Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant HDAC1 |
Bioorg Med Chem Lett 16: 4048-52 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.005
BindingDB Entry DOI: 10.7270/Q2CF9PP5 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50187089
(3-(6-(4-fluorobenzylamino)pyridin-3-yl)-N-(2-amino...)Show SMILES Nc1ccccc1NC(=O)\C=C\c1ccc(NCc2ccc(F)cc2)nc1 Show InChI InChI=1S/C21H19FN4O/c22-17-9-5-15(6-10-17)13-24-20-11-7-16(14-25-20)8-12-21(27)26-19-4-2-1-3-18(19)23/h1-12,14H,13,23H2,(H,24,25)(H,26,27)/b12-8+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
MethylGene Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant HDAC1 |
Bioorg Med Chem Lett 16: 4048-52 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.005
BindingDB Entry DOI: 10.7270/Q2CF9PP5 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50187101
(6-(3,4,5-trimethoxybenzylamino)-N-(2-aminophenyl)n...)Show SMILES COc1cc(CNc2ccc(cn2)C(=O)Nc2ccccc2N)cc(OC)c1OC Show InChI InChI=1S/C22H24N4O4/c1-28-18-10-14(11-19(29-2)21(18)30-3)12-24-20-9-8-15(13-25-20)22(27)26-17-7-5-4-6-16(17)23/h4-11,13H,12,23H2,1-3H3,(H,24,25)(H,26,27) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
MethylGene Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant HDAC1 |
Bioorg Med Chem Lett 16: 4048-52 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.005
BindingDB Entry DOI: 10.7270/Q2CF9PP5 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50187087
((E)-3-(4-(4-(trifluoromethoxy)benzylamino)phenyl)-...)Show SMILES Nc1ccccc1NC(=O)\C=C\c1ccc(NCc2ccc(OC(F)(F)F)cc2)cc1 Show InChI InChI=1S/C23H20F3N3O2/c24-23(25,26)31-19-12-7-17(8-13-19)15-28-18-10-5-16(6-11-18)9-14-22(30)29-21-4-2-1-3-20(21)27/h1-14,28H,15,27H2,(H,29,30)/b14-9+ | 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 | 5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
MethylGene Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant HDAC1 |
Bioorg Med Chem Lett 16: 4048-52 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.005
BindingDB Entry DOI: 10.7270/Q2CF9PP5 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50187095
((E)-N-(2-aminophenyl)-3-(4-(pyridin-4-ylmethylamin...)Show InChI InChI=1S/C21H20N4O/c22-19-3-1-2-4-20(19)25-21(26)10-7-16-5-8-18(9-6-16)24-15-17-11-13-23-14-12-17/h1-14,24H,15,22H2,(H,25,26)/b10-7+ | 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 | 1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
MethylGene Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant HDAC1 |
Bioorg Med Chem Lett 16: 4048-52 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.005
BindingDB Entry DOI: 10.7270/Q2CF9PP5 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50187088
((E)-N-(2-aminophenyl)-3-(4-((phenylamino)methyl)ph...)Show InChI InChI=1S/C22H21N3O/c23-20-8-4-5-9-21(20)25-22(26)15-14-17-10-12-18(13-11-17)16-24-19-6-2-1-3-7-19/h1-15,24H,16,23H2,(H,25,26)/b15-14+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.70E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
MethylGene Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant HDAC1 |
Bioorg Med Chem Lett 16: 4048-52 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.005
BindingDB Entry DOI: 10.7270/Q2CF9PP5 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50187100
((E)-N-(2-aminophenyl)-3-(4-((3-methoxyphenylamino)...)Show SMILES COc1cccc(NCc2ccc(\C=C\C(=O)Nc3ccccc3N)cc2)c1 Show InChI InChI=1S/C23H23N3O2/c1-28-20-6-4-5-19(15-20)25-16-18-11-9-17(10-12-18)13-14-23(27)26-22-8-3-2-7-21(22)24/h2-15,25H,16,24H2,1H3,(H,26,27)/b14-13+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.70E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
MethylGene Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant HDAC1 |
Bioorg Med Chem Lett 16: 4048-52 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.005
BindingDB Entry DOI: 10.7270/Q2CF9PP5 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50187103
((E)-N-(2-aminophenyl)-3-(4-((2-methoxyphenylamino)...)Show InChI InChI=1S/C23H23N3O2/c1-28-22-9-5-4-8-21(22)25-16-18-12-10-17(11-13-18)14-15-23(27)26-20-7-3-2-6-19(20)24/h2-15,25H,16,24H2,1H3,(H,26,27)/b15-14+ | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
MethylGene Inc.
Curated by ChEMBL
| Assay Description
Inhibition of human recombinant HDAC1 |
Bioorg Med Chem Lett 16: 4048-52 (2006)
Article DOI: 10.1016/j.bmcl.2006.05.005
BindingDB Entry DOI: 10.7270/Q2CF9PP5 |
More data for this
Ligand-Target Pair | |
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