BindingDB logo
myBDB logout

2 similar compounds to monomer 50398426

Compile data set for download or QSAR
Wt: 316.7
BDBM50398433
Wt: 330.8
BDBM50398435

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50398433,50398435   
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 (IMPDH)


(Cryptosporidium parvum)
BDBM50398433
PNG
(CHEMBL2178637)
Show SMILES CC(NC(=O)Nc1ccc(Cl)cc1)c1cccc(c1)C(C)=O
Show InChI InChI=1S/C17H17ClN2O2/c1-11(13-4-3-5-14(10-13)12(2)21)19-17(22)20-16-8-6-15(18)7-9-16/h3-11H,1-2H3,(H2,19,20,22)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 110n/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 in presence of 0.05% fatty acid f...


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 (IMPDH)


(Cryptosporidium parvum)
BDBM50398435
PNG
(CHEMBL2178634)
Show SMILES CC(=O)c1cccc(c1)C(C)(C)NC(=O)Nc1ccc(Cl)cc1
Show InChI InChI=1S/C18H19ClN2O2/c1-12(22)13-5-4-6-14(11-13)18(2,3)21-17(23)20-16-9-7-15(19)8-10-16/h4-11H,1-3H3,(H2,20,21,23)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 39n/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 (IMPDH)


(Cryptosporidium parvum)
BDBM50398435
PNG
(CHEMBL2178634)
Show SMILES CC(=O)c1cccc(c1)C(C)(C)NC(=O)Nc1ccc(Cl)cc1
Show InChI InChI=1S/C18H19ClN2O2/c1-12(22)13-5-4-6-14(11-13)18(2,3)21-17(23)20-16-9-7-15(19)8-10-16/h4-11H,1-3H3,(H2,20,21,23)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 64n/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 in presence of 0.05% fatty acid f...


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 (IMPDH)


(Cryptosporidium parvum)
BDBM50398433
PNG
(CHEMBL2178637)
Show SMILES CC(NC(=O)Nc1ccc(Cl)cc1)c1cccc(c1)C(C)=O
Show InChI InChI=1S/C17H17ClN2O2/c1-11(13-4-3-5-14(10-13)12(2)21)19-17(22)20-16-8-6-15(18)7-9-16/h3-11H,1-2H3,(H2,19,20,22)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 70n/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