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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Histidinol dehydrogenase' and Ligand = 'BDBM50267972'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Histidinol dehydrogenase


(Brucella suis)
BDBM50267972
PNG
((S)-3-Amino-4-(1H-imidazol-4-yl)-1-phenyl-butan-2-...)
Show SMILES N[C@@H](Cc1cnc[nH]1)C(=O)Cc1ccccc1 |r|
Show InChI InChI=1S/C13H15N3O/c14-12(7-11-8-15-9-16-11)13(17)6-10-4-2-1-3-5-10/h1-5,8-9,12H,6-7,14H2,(H,15,16)/t12-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 6n/an/an/an/an/an/a



Université Montpellier II

Curated by ChEMBL


Assay Description
Inhibition of Brucella suis histidinol dehydrogenase


Antimicrob Agents Chemother 51: 3752-5 (2007)


Article DOI: 10.1128/AAC.00572-07
BindingDB Entry DOI: 10.7270/Q24T6J58
More data for this
Ligand-Target Pair
Histidinol dehydrogenase


(Brucella suis)
BDBM50267972
PNG
((S)-3-Amino-4-(1H-imidazol-4-yl)-1-phenyl-butan-2-...)
Show SMILES N[C@@H](Cc1cnc[nH]1)C(=O)Cc1ccccc1 |r|
Show InChI InChI=1S/C13H15N3O/c14-12(7-11-8-15-9-16-11)13(17)6-10-4-2-1-3-5-10/h1-5,8-9,12H,6-7,14H2,(H,15,16)/t12-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 40n/an/an/an/an/an/a



Ecole Nationale Sup£rieure de Chimie de Montpellier

Curated by ChEMBL


Assay Description
Inhibition of Brucella suis histidinol dehydrogenase


Bioorg Med Chem 15: 4427-33 (2007)


Article DOI: 10.1016/j.bmc.2007.04.027
BindingDB Entry DOI: 10.7270/Q2V125MM
More data for this
Ligand-Target Pair