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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 = 50115142   
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))
BDBM50115142
PNG
(CHEMBL99500 | N*2*-Methyl-6,7-diphenyl-5,6,7,8-tet...)
Show SMILES CNc1nc(N)c2NC(C(Nc2n1)c1ccccc1)c1ccccc1
Show InChI InChI=1/C19H20N6/c1-21-19-24-17(20)16-18(25-19)23-15(13-10-6-3-7-11-13)14(22-16)12-8-4-2-5-9-12/h2-11,14-15,22H,1H3,(H4,20,21,23,24,25)
PDB
MMDB

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PC sid
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Similars

Article
PubMed
n/an/a 3.00E+4n/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