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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 = 50115148   
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))
BDBM50115148
PNG
(CHEMBL101037 | N-[6-(4-Azido-phenyl)-4-oxo-3,4-dih...)
Show SMILES CC(C)C(=O)Nc1nc2ncc(nc2c(=O)[nH]1)-c1ccc(cc1)N=[N+]=[N-]
Show InChI InChI=1S/C16H14N8O2/c1-8(2)14(25)21-16-20-13-12(15(26)22-16)19-11(7-18-13)9-3-5-10(6-4-9)23-24-17/h3-8H,1-2H3,(H2,18,20,21,22,25,26)
PDB
MMDB

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Similars

Article
PubMed
n/an/a 4.20E+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