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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Nitric Oxide Synthase, inducible' and Monomerid = 50128919   
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))
BDBM50128919
PNG
((3aR,9bS)-7-(2-Methylamino-ethoxy)-2,3,3a,9b-tetra...)
Show SMILES CNCCOc1ccc2[C@H]3CCC[C@H]3C(N)=Nc2c1
Show InChI InChI=1S/C15H21N3O/c1-17-7-8-19-10-5-6-12-11-3-2-4-13(11)15(16)18-14(12)9-10/h5-6,9,11,13,17H,2-4,7-8H2,1H3,(H2,16,18)/t11-,13-/m1/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.90E+3n/an/an/an/an/an/a



Schering AG

Curated by ChEMBL


Assay Description
Inhibitory concentration against human Inducible nitric oxide synthase


Bioorg Med Chem Lett 13: 1981-4 (2003)


Article DOI: 10.1016/s0960-894x(03)00351-2
BindingDB Entry DOI: 10.7270/Q2FN16QG
More data for this
Ligand-Target Pair