BindingDB logo
myBDB logout

BDBM50517580 CHEMBL4442134

SMILES: ONC(=O)c1ccc(cc1)N1c2ccccc2Sc2ccccc12

InChI Key: InChIKey=USSSSHLQPDQGMW-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50517580   
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
Cereblon/Histone deacetylase 6


(Homo sapiens (Human))
BDBM50517580
PNG
(CHEMBL4442134)
Show SMILES ONC(=O)c1ccc(cc1)N1c2ccccc2Sc2ccccc12
Show InChI InChI=1S/C19H14N2O2S/c22-19(20-23)13-9-11-14(12-10-13)21-15-5-1-3-7-17(15)24-18-8-4-2-6-16(18)21/h1-12,23H,(H,20,22)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.67E+3n/an/an/an/an/an/a



Ludwig-Maximilians University Munich

Curated by ChEMBL


Assay Description
Inhibition of recombinant N-terminal GST-tagged human HDAC6 expressed in baculovirus expression system using fluorogenic ZMAL as substrate incubated ...


J Med Chem 62: 1138-1166 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01090
More data for this
Ligand-Target Pair