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BDBM50398426 CHEMBL2178638

SMILES: CC(=O)c1cccc(CNC(=O)Nc2ccc(Cl)cc2)c1

InChI Key: InChIKey=UPQVCGSKRBMVRP-UHFFFAOYSA-N

Data: 3 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50398426   
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
Inosine-5'-monophosphate dehydrogenase, probable


(Cryptosporidium parvum)
BDBM50398426
PNG
(CHEMBL2178638)
Show SMILES CC(=O)c1cccc(CNC(=O)Nc2ccc(Cl)cc2)c1
Show InChI InChI=1S/C16H15ClN2O2/c1-11(20)13-4-2-3-12(9-13)10-18-16(21)19-15-7-5-14(17)6-8-15/h2-9H,10H2,1H3,(H2,18,19,21)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>5.00E+3n/an/an/an/an/an/a



Brandeis University

Curated by ChEMBL


Assay Description
Inhibition of Cryptosporidium IMPDH preincubated for 10 mins before substrate addition by spectrophotometry


ACS Med Chem Lett 5: 846-50 (2014)


Article DOI: 10.1021/ml500203p
BindingDB Entry DOI: 10.7270/Q23J3FN3
More data for this
Ligand-Target Pair
Inosine-5-monophosphate dehydrogenase (IMPDH)


(Cryptosporidium parvum)
BDBM50398426
PNG
(CHEMBL2178638)
Show SMILES CC(=O)c1cccc(CNC(=O)Nc2ccc(Cl)cc2)c1
Show InChI InChI=1S/C16H15ClN2O2/c1-11(20)13-4-2-3-12(9-13)10-18-16(21)19-15-7-5-14(17)6-8-15/h2-9H,10H2,1H3,(H2,18,19,21)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 5.00E+3n/an/an/an/an/an/a



Brandeis University

Curated by ChEMBL


Assay Description
Inhibition of Cryptosporidium parvum recombinant IMPDH expressed in Escherichia coli assessed as production of NADH incubated for 5 mins by fluoresce...


J Med Chem 55: 7759-71 (2012)


Article DOI: 10.1021/jm3007917
BindingDB Entry DOI: 10.7270/Q2GM88GS
More data for this
Ligand-Target Pair
Inosine-5'-monophosphate dehydrogenase


(Bacillus anthracis)
BDBM50398426
PNG
(CHEMBL2178638)
Show SMILES CC(=O)c1cccc(CNC(=O)Nc2ccc(Cl)cc2)c1
Show InChI InChI=1S/C16H15ClN2O2/c1-11(20)13-4-2-3-12(9-13)10-18-16(21)19-15-7-5-14(17)6-8-15/h2-9H,10H2,1H3,(H2,18,19,21)
PDB

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.20E+3n/an/an/an/an/an/a



Brandeis University

Curated by ChEMBL


Assay Description
Inhibition of Bacillus anthracis IMPDH preincubated for 10 mins before substrate addition by spectrophotometry


ACS Med Chem Lett 5: 846-50 (2014)


Article DOI: 10.1021/ml500203p
BindingDB Entry DOI: 10.7270/Q23J3FN3
More data for this
Ligand-Target Pair