BDBM50137845 6-(5-Methyl-1,3-dioxo-1,3-dihydro-isoindol-2-yl)-hexanoic acid (2-amino-phenyl)-amide::CHEMBL97560
SMILES: Cc1ccc2C(=O)N(CCCCCC(=O)Nc3ccccc3N)C(=O)c2c1
InChI Key: InChIKey=JMPDTJFOVRXYNL-UHFFFAOYSA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 2 hits for monomerid = 50137845 Target/Host
(Institution) | Ligand | Target/Host
Links | Ligand
Links | Trg + Lig
Links | Ki
nM | ΔG°
kcal/mole | IC50
nM | Kd
nM | EC50/IC50
nM | koff
s-1 | kon
M-1s-1 | pH | Temp
°C |
|---|
Histone deacetylase
(Homo sapiens (Human)) | BDBM50137845
(6-(5-Methyl-1,3-dioxo-1,3-dihydro-isoindol-2-yl)-h...)Show SMILES Cc1ccc2C(=O)N(CCCCCC(=O)Nc3ccccc3N)C(=O)c2c1 Show InChI InChI=1S/C21H23N3O3/c1-14-10-11-15-16(13-14)21(27)24(20(15)26)12-6-2-3-9-19(25)23-18-8-5-4-7-17(18)22/h4-5,7-8,10-11,13H,2-3,6,9,12,22H2,1H3,(H,23,25) | PDB
UniProtKB/SwissProt
UniProtKB/TrEMBL
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | n/a | n/a | 3.00E+3 | n/a | n/a | n/a | n/a |
MethylGene Inc.
Curated by ChEMBL
| Assay Description
Effect on induced hyperacetylation of histones in whole cells |
Bioorg Med Chem Lett 14: 283-7 (2003)
BindingDB Entry DOI: 10.7270/Q2BV7G17 |
More data for this
Ligand-Target Pair | |
Histone deacetylase 1
(Homo sapiens (Human)) | BDBM50137845
(6-(5-Methyl-1,3-dioxo-1,3-dihydro-isoindol-2-yl)-h...)Show SMILES Cc1ccc2C(=O)N(CCCCCC(=O)Nc3ccccc3N)C(=O)c2c1 Show InChI InChI=1S/C21H23N3O3/c1-14-10-11-15-16(13-14)21(27)24(20(15)26)12-6-2-3-9-19(25)23-18-8-5-4-7-17(18)22/h4-5,7-8,10-11,13H,2-3,6,9,12,22H2,1H3,(H,23,25) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| 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
Ability to inhibit recombinant human histone deacetylase 1 (HDAC-1). |
Bioorg Med Chem Lett 14: 283-7 (2003)
BindingDB Entry DOI: 10.7270/Q2BV7G17 |
More data for this
Ligand-Target Pair | |
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