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BDBM50144212 CHEMBL3759941

SMILES: SCCCCCCNC(=O)c1ccn[nH]1

InChI Key: InChIKey=OJQALHBLSWWPHJ-UHFFFAOYSA-N

Data: 3 IC50

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 3 hits for monomerid = 50144212   
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))
BDBM50144212
PNG
(CHEMBL3759941)
Show SMILES SCCCCCCNC(=O)c1ccn[nH]1
Show InChI InChI=1S/C10H17N3OS/c14-10(9-5-7-12-13-9)11-6-3-1-2-4-8-15/h5,7,15H,1-4,6,8H2,(H,11,14)(H,12,13)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a 526n/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human HDAC1 using Boc-Lys(Ac)-AMC as substrate preincubated for 15 mins followed by substrate addition measured after 60 mi...


Eur J Med Chem 109: 350-9 (2016)


BindingDB Entry DOI: 10.7270/Q20C4XM5
More data for this
Ligand-Target Pair
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM50144212
PNG
(CHEMBL3759941)
Show SMILES SCCCCCCNC(=O)c1ccn[nH]1
Show InChI InChI=1S/C10H17N3OS/c14-10(9-5-7-12-13-9)11-6-3-1-2-4-8-15/h5,7,15H,1-4,6,8H2,(H,11,14)(H,12,13)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a 92n/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human HDAC6 using Boc-Lys(Ac)-AMC as substrate preincubated for 15 mins followed by substrate addition measured after 60 mi...


Eur J Med Chem 109: 350-9 (2016)


BindingDB Entry DOI: 10.7270/Q20C4XM5
More data for this
Ligand-Target Pair
Histone deacetylase


(Homo sapiens (Human))
BDBM50144212
PNG
(CHEMBL3759941)
Show SMILES SCCCCCCNC(=O)c1ccn[nH]1
Show InChI InChI=1S/C10H17N3OS/c14-10(9-5-7-12-13-9)11-6-3-1-2-4-8-15/h5,7,15H,1-4,6,8H2,(H,11,14)(H,12,13)
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/a 81n/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of HDAC in human HeLa cell nuclear extract using Boc-Lys(Ac)-AMC as substrate preincubated for 15 mins followed by substrate addition meas...


Eur J Med Chem 109: 350-9 (2016)


BindingDB Entry DOI: 10.7270/Q20C4XM5
More data for this
Ligand-Target Pair