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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Nitric oxide synthase, inducible' and Monomerid = 50030277   
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
Nitric oxide synthase, inducible


(Homo sapiens (Human))
BDBM50030277
PNG
((R)-6-Acetimidoylamino-2-amino-hexanoic acid | CHE...)
Show SMILES CC(=N)NCCCC[C@@H](N)C(O)=O
Show InChI InChI=1S/C8H17N3O2/c1-6(9)11-5-3-2-4-7(10)8(12)13/h7H,2-5,10H2,1H3,(H2,9,11)(H,12,13)/t7-/m1/s1
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PC cid
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Article
PubMed
n/an/a 1.60E+3n/an/an/an/an/an/a



Glaxo Wellcome Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human inducible nitric oxide synthase


Bioorg Med Chem Lett 10: 597-600 (2000)


Article DOI: 10.1016/s0960-894x(00)00055-x
BindingDB Entry DOI: 10.7270/Q21C1XDN
More data for this
Ligand-Target Pair
Nitric Oxide Synthase, inducible


(Mus musculus (mouse))
BDBM50030277
PNG
((R)-6-Acetimidoylamino-2-amino-hexanoic acid | CHE...)
Show SMILES CC(=N)NCCCC[C@@H](N)C(O)=O
Show InChI InChI=1S/C8H17N3O2/c1-6(9)11-5-3-2-4-7(10)8(12)13/h7H,2-5,10H2,1H3,(H2,9,11)(H,12,13)/t7-/m1/s1
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PC cid
PC sid
UniChem

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Article
PubMed
n/an/a 3.36E+5n/an/an/an/an/an/a



G. D. Searle Research and Development

Curated by ChEMBL


Assay Description
Tested for inhibition of mouse inducible nitric oxide synthase


J Med Chem 37: 3886-8 (1994)


Article DOI: 10.1021/jm00049a007
BindingDB Entry DOI: 10.7270/Q29P328V
More data for this
Ligand-Target Pair
Nitric oxide synthase, inducible


(Rattus norvegicus)
BDBM50030277
PNG
((R)-6-Acetimidoylamino-2-amino-hexanoic acid | CHE...)
Show SMILES CC(=N)NCCCC[C@@H](N)C(O)=O
Show InChI InChI=1S/C8H17N3O2/c1-6(9)11-5-3-2-4-7(10)8(12)13/h7H,2-5,10H2,1H3,(H2,9,11)(H,12,13)/t7-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
Purchase

CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.80E+6n/an/an/an/an/an/a



G. D. Searle Research and Development

Curated by ChEMBL


Assay Description
Tested for inhibition of rat brain inducible nitric oxide synthase


J Med Chem 37: 3886-8 (1994)


Article DOI: 10.1021/jm00049a007
BindingDB Entry DOI: 10.7270/Q29P328V
More data for this
Ligand-Target Pair