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BDBM50278469 CHEMBL469378::methyl 4-(2-amino-5-(thiophen-2-yl)phenylcarbamoyl)benzyl(methyl)phosphinate

SMILES: COP(C)(=O)Cc1ccc(cc1)C(=O)Nc1cc(ccc1N)-c1cccs1

InChI Key: InChIKey=BPMHDNJABBOROI-UHFFFAOYNA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50278469   
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))
BDBM50278469
PNG
(CHEMBL469378 | methyl 4-(2-amino-5-(thiophen-2-yl)...)
Show SMILES COP(C)(=O)Cc1ccc(cc1)C(=O)Nc1cc(ccc1N)-c1cccs1
Show InChI InChI=1/C20H21N2O3PS/c1-25-26(2,24)13-14-5-7-15(8-6-14)20(23)22-18-12-16(9-10-17(18)21)19-4-3-11-27-19/h3-12H,13,21H2,1-2H3,(H,22,23)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 54n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of HDAC1


Bioorg Med Chem Lett 19: 2053-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.009
BindingDB Entry DOI: 10.7270/Q2QV3MDQ
More data for this
Ligand-Target Pair