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BDBM50317987 CHEMBL1096072::N-(4-amino-4'-(trifluoromethyl)biphenyl-3-yl)benzamide

SMILES: Nc1ccc(cc1NC(=O)c1ccccc1)-c1ccc(cc1)C(F)(F)F

InChI Key: InChIKey=SXNSPGPBTATFRJ-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50317987   
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 2


(Homo sapiens (Human))
BDBM50317987
PNG
(CHEMBL1096072 | N-(4-amino-4'-(trifluoromethyl)bip...)
Show SMILES Nc1ccc(cc1NC(=O)c1ccccc1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C20H15F3N2O/c21-20(22,23)16-9-6-13(7-10-16)15-8-11-17(24)18(12-15)25-19(26)14-4-2-1-3-5-14/h1-12H,24H2,(H,25,26)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 4.00E+4n/an/an/an/an/an/a



Takeda San Diego

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC2 preincubated for 1 hr with substrate by protease coupled end-point assay


Bioorg Med Chem Lett 20: 3142-5 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.091
BindingDB Entry DOI: 10.7270/Q2HX1CT8
More data for this
Ligand-Target Pair
Histone deacetylase 2


(Homo sapiens (Human))
BDBM50317987
PNG
(CHEMBL1096072 | N-(4-amino-4'-(trifluoromethyl)bip...)
Show SMILES Nc1ccc(cc1NC(=O)c1ccccc1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C20H15F3N2O/c21-20(22,23)16-9-6-13(7-10-16)15-8-11-17(24)18(12-15)25-19(26)14-4-2-1-3-5-14/h1-12H,24H2,(H,25,26)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 3.80E+3n/an/an/an/an/an/a



Takeda San Diego

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC2 preincubated for 24 hrs followed by 1 hr reaction with substrate by protease coupled end-point assay


Bioorg Med Chem Lett 20: 3142-5 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.091
BindingDB Entry DOI: 10.7270/Q2HX1CT8
More data for this
Ligand-Target Pair