BindingDB logo
myBDB logout

BDBM50144211 CHEMBL3758451

SMILES: SCCCCCCNC(=O)c1cc(n[nH]1)C1CCCCC1

InChI Key: InChIKey=IZLZQCGILASHEY-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 = 50144211   
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))
BDBM50144211
PNG
(CHEMBL3758451)
Show SMILES SCCCCCCNC(=O)c1cc(n[nH]1)C1CCCCC1
Show InChI InChI=1S/C16H27N3OS/c20-16(17-10-6-1-2-7-11-21)15-12-14(18-19-15)13-8-4-3-5-9-13/h12-13,21H,1-11H2,(H,17,20)(H,18,19)
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 331n/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))
BDBM50144211
PNG
(CHEMBL3758451)
Show SMILES SCCCCCCNC(=O)c1cc(n[nH]1)C1CCCCC1
Show InChI InChI=1S/C16H27N3OS/c20-16(17-10-6-1-2-7-11-21)15-12-14(18-19-15)13-8-4-3-5-9-13/h12-13,21H,1-11H2,(H,17,20)(H,18,19)
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 241n/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))
BDBM50144211
PNG
(CHEMBL3758451)
Show SMILES SCCCCCCNC(=O)c1cc(n[nH]1)C1CCCCC1
Show InChI InChI=1S/C16H27N3OS/c20-16(17-10-6-1-2-7-11-21)15-12-14(18-19-15)13-8-4-3-5-9-13/h12-13,21H,1-11H2,(H,17,20)(H,18,19)
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 364n/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