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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 Monomerid = 50115129   
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))
BDBM50115129
PNG
(CHEMBL99497 | N-(2-Amino-6,7-diphenyl-pteridin-4-y...)
Show SMILES CC(C)C(=O)Nc1nc(N)nc2nc(-c3ccccc3)c(nc12)-c1ccccc1
Show InChI InChI=1S/C22H20N6O/c1-13(2)21(29)26-20-18-19(27-22(23)28-20)25-17(15-11-7-4-8-12-15)16(24-18)14-9-5-3-6-10-14/h3-13H,1-2H3,(H3,23,25,26,27,28,29)
PDB
MMDB

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Similars

Article
PubMed
n/an/a 1.92E+5n/an/an/an/an/an/a



Aventis Pharma

Curated by ChEMBL


Assay Description
Inhibitory activity against human neuronal nitric oxide synthase (NOS-I)


J Med Chem 45: 2923-41 (2002)


Article DOI: 10.1021/jm020074g
BindingDB Entry DOI: 10.7270/Q2571BBK
More data for this
Ligand-Target Pair