new BindingDB logo
myBDB logout

BDBM50015235 CHEMBL3262725

SMILES: ONC(=O)\C=C\c1cccc(c1)S(=O)(=O)n1ccc2ccncc12

InChI Key: InChIKey=NJVZZEMNCXUOEJ-SNAWJCMRSA-N

Data: 2 IC50

PDB links: 2 PDB IDs match this monomer.

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 = 50015235   
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 6


(Homo sapiens (Human))
BDBM50015235
PNG
(CHEMBL3262725)
Show SMILES ONC(=O)\C=C\c1cccc(c1)S(=O)(=O)n1ccc2ccncc12
Show InChI InChI=1S/C16H13N3O4S/c20-16(18-21)5-4-12-2-1-3-14(10-12)24(22,23)19-9-7-13-6-8-17-11-15(13)19/h1-11,21H,(H,18,20)/b5-4+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

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

Patents

Article
PubMed
n/an/a 280n/an/an/an/an/an/a



Taipei Medical University

Curated by ChEMBL


Assay Description
Inhibition of HDAC6 (unknown origin) using RHKK(Ac) (379 to 382) p53 peptide as substrate by fluorescence assay


J Med Chem 57: 4009-22 (2014)


Article DOI: 10.1021/jm401899x
BindingDB Entry DOI: 10.7270/Q28917F9
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM50015235
PNG
(CHEMBL3262725)
Show SMILES ONC(=O)\C=C\c1cccc(c1)S(=O)(=O)n1ccc2ccncc12
Show InChI InChI=1S/C16H13N3O4S/c20-16(18-21)5-4-12-2-1-3-14(10-12)24(22,23)19-9-7-13-6-8-17-11-15(13)19/h1-11,21H,(H,18,20)/b5-4+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Patents

Article
PubMed
n/an/a 4.85E+3n/an/an/an/an/an/a



Taipei Medical University

Curated by ChEMBL


Assay Description
Inhibition of HDAC1 (unknown origin) using RHKK(Ac) (379 to 382) p53 peptide as substrate by fluorescence assay


J Med Chem 57: 4009-22 (2014)


Article DOI: 10.1021/jm401899x
BindingDB Entry DOI: 10.7270/Q28917F9
More data for this
Ligand-Target Pair