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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Nitric oxide synthase, brain' and Ligand = 'BDBM50373696'   
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, brain


(Homo sapiens (Human))
BDBM50373696
PNG
(CHEMBL403871)
Show SMILES CC(=O)C1Nc2c(NC1(C)C)nc(N)[nH]c2=O
Show InChI InChI=1S/C10H15N5O2/c1-4(16)6-10(2,3)15-7-5(12-6)8(17)14-9(11)13-7/h6,12H,1-3H3,(H4,11,13,14,15,17)
PDB
MMDB

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PC cid
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Similars

Article
PubMed
n/an/an/a 1.51E+5n/an/an/an/an/a



University of Strathclyde

Curated by ChEMBL


Assay Description
Activity of tetrahydrobiopterin free nNOS


Bioorg Med Chem Lett 18: 1563-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.01.079
BindingDB Entry DOI: 10.7270/Q2V40W2D
More data for this
Ligand-Target Pair