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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Ornithine transcarbamylase, mitochondrial' and Ligand = 'BDBM50079025'   
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
Ornithine transcarbamylase, mitochondrial


(Homo sapiens (Human))
BDBM50079025
PNG
((2S)-2-ammonio-4-[({[(hydroxyphosphinato)methyl]ph...)
Show SMILES [NH3+][C@@H](CC[NH2+]CP([O-])(=O)CP(O)([O-])=O)C([O-])=O
Show InChI InChI=1S/C6H16N2O7P2/c7-5(6(9)10)1-2-8-3-16(11,12)4-17(13,14)15/h5,8H,1-4,7H2,(H,9,10)(H,11,12)(H2,13,14,15)/p-1/t5-/m0/s1
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PC cid
PC sid
UniChem
Article
PubMed
2.30E+6n/an/an/an/an/an/a7.0n/a



Universit£tstrasse 16

Curated by ChEMBL


Assay Description
Binding affinity against ornithine transcarbamoylase (OTC) produced by Streptococcus faecalis The buffer taken for this study is 50 mM Tris.HCl, 0.5 ...


J Med Chem 42: 2633-40 (1999)


Article DOI: 10.1021/jm991008q
BindingDB Entry DOI: 10.7270/Q2NV9JX8
More data for this
Ligand-Target Pair
Ornithine transcarbamylase, mitochondrial


(Homo sapiens (Human))
BDBM50079025
PNG
((2S)-2-ammonio-4-[({[(hydroxyphosphinato)methyl]ph...)
Show SMILES [NH3+][C@@H](CC[NH2+]CP([O-])(=O)CP(O)([O-])=O)C([O-])=O
Show InChI InChI=1S/C6H16N2O7P2/c7-5(6(9)10)1-2-8-3-16(11,12)4-17(13,14)15/h5,8H,1-4,7H2,(H,9,10)(H,11,12)(H2,13,14,15)/p-1/t5-/m0/s1
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PC cid
PC sid
UniChem
Article
PubMed
3.20E+6n/an/an/an/an/an/a8.0n/a



Universit£tstrasse 16

Curated by ChEMBL


Assay Description
Binding affinity against ornithine transcarbamoylase (OTC) produced by Streptococcus faecalis The buffer taken for this study is 50 mM Tris.HCl, 0.5 ...


J Med Chem 42: 2633-40 (1999)


Article DOI: 10.1021/jm991008q
BindingDB Entry DOI: 10.7270/Q2NV9JX8
More data for this
Ligand-Target Pair
Ornithine transcarbamylase, mitochondrial


(Homo sapiens (Human))
BDBM50079025
PNG
((2S)-2-ammonio-4-[({[(hydroxyphosphinato)methyl]ph...)
Show SMILES [NH3+][C@@H](CC[NH2+]CP([O-])(=O)CP(O)([O-])=O)C([O-])=O
Show InChI InChI=1S/C6H16N2O7P2/c7-5(6(9)10)1-2-8-3-16(11,12)4-17(13,14)15/h5,8H,1-4,7H2,(H,9,10)(H,11,12)(H2,13,14,15)/p-1/t5-/m0/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
>2.00E+7n/an/an/an/an/an/a6.0n/a



Universit£tstrasse 16

Curated by ChEMBL


Assay Description
Binding affinity against ornithine transcarbamoylase (OTC) produced by Streptococcus faecalis The buffer taken for this study is 50 mM maleate, 0.5 m...


J Med Chem 42: 2633-40 (1999)


Article DOI: 10.1021/jm991008q
BindingDB Entry DOI: 10.7270/Q2NV9JX8
More data for this
Ligand-Target Pair