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BDBM50144917 CHEMBL3764826

SMILES: CC(C)C[C@H](NC(=O)Nc1ccc(C)c(Cl)c1)C(=O)NO

InChI Key: InChIKey=GQZGLBVLOYTYEW-LBPRGKRZSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50144917   
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
HDACs


(Homo sapiens (human))
BDBM50144917
PNG
(CHEMBL3764826)
Show SMILES CC(C)C[C@H](NC(=O)Nc1ccc(C)c(Cl)c1)C(=O)NO
Show InChI InChI=1S/C14H20ClN3O3/c1-8(2)6-12(13(19)18-21)17-14(20)16-10-5-4-9(3)11(15)7-10/h4-5,7-8,12,21H,6H2,1-3H3,(H,18,19)(H2,16,17,20)/t12-/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Fudan University

Curated by ChEMBL


Assay Description
Inhibition of HDAC1/HDAC2 in human HeLa cells nuclear extract preincubated for 5 mins before Boc-Lys (acetyl)-AMC substrate addition for 30 mins by m...


Eur J Med Chem 108: 21-7 (2016)


Article DOI: 10.1016/j.ejmech.2015.11.021
BindingDB Entry DOI: 10.7270/Q2ZC84RN
More data for this
Ligand-Target Pair
Aminopeptidase N


(Sus scrofa (Pig))
BDBM50144917
PNG
(CHEMBL3764826)
Show SMILES CC(C)C[C@H](NC(=O)Nc1ccc(C)c(Cl)c1)C(=O)NO
Show InChI InChI=1S/C14H20ClN3O3/c1-8(2)6-12(13(19)18-21)17-14(20)16-10-5-4-9(3)11(15)7-10/h4-5,7-8,12,21H,6H2,1-3H3,(H,18,19)(H2,16,17,20)/t12-/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 90n/an/an/an/an/an/a



Fudan University

Curated by ChEMBL


Assay Description
Inhibition of APN in porcine kidney microsomes preincubated for 5 mins before L-leu-p-nitroanilide substrate addition for 30 mins by plate reader ana...


Eur J Med Chem 108: 21-7 (2016)


Article DOI: 10.1016/j.ejmech.2015.11.021
BindingDB Entry DOI: 10.7270/Q2ZC84RN
More data for this
Ligand-Target Pair