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BDBM50372441 CHEMBL260958

SMILES: Nc1ccccc1NC(=O)CCCCCCNC(=O)c1cccc(c1)-c1ccccc1

InChI Key: InChIKey=APXRYINGSDDHKM-UHFFFAOYSA-N

Data: 1 IC50  1 EC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50372441   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Histone deacetylase 1


(Homo sapiens (Human))
BDBM50372441
PNG
(CHEMBL260958)
Show SMILES Nc1ccccc1NC(=O)CCCCCCNC(=O)c1cccc(c1)-c1ccccc1
Show InChI InChI=1S/C26H29N3O2/c27-23-15-7-8-16-24(23)29-25(30)17-6-1-2-9-18-28-26(31)22-14-10-13-21(19-22)20-11-4-3-5-12-20/h3-5,7-8,10-16,19H,1-2,6,9,17-18,27H2,(H,28,31)(H,29,30)
PDB
MMDB

NCI pathway
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KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
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AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 2.50E+4n/an/an/an/a



Menarini Ricerche

Curated by ChEMBL


Assay Description
Inhibition of human HDAC1 assessed as histone H4 acetylation in cell based assay


J Med Chem 51: 1505-29 (2008)


Article DOI: 10.1021/jm7011408
BindingDB Entry DOI: 10.7270/Q2M32WMT
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM50372441
PNG
(CHEMBL260958)
Show SMILES Nc1ccccc1NC(=O)CCCCCCNC(=O)c1cccc(c1)-c1ccccc1
Show InChI InChI=1S/C26H29N3O2/c27-23-15-7-8-16-24(23)29-25(30)17-6-1-2-9-18-28-26(31)22-14-10-13-21(19-22)20-11-4-3-5-12-20/h3-5,7-8,10-16,19H,1-2,6,9,17-18,27H2,(H,28,31)(H,29,30)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.00E+3n/an/an/an/an/an/a



Menarini Ricerche

Curated by ChEMBL


Assay Description
Inhibition of human HDAC1


J Med Chem 51: 1505-29 (2008)


Article DOI: 10.1021/jm7011408
BindingDB Entry DOI: 10.7270/Q2M32WMT
More data for this
Ligand-Target Pair