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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 = 50115168   
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))
BDBM50115168
PNG
(6-(4-Methoxy-phenyl)-N*4*,N*4*-dipropyl-5,6,7,8-te...)
Show SMILES CCCN(CCC)c1nc(N)nc2NCC(Nc12)c1ccc(OC)cc1
Show InChI InChI=1/C19H28N6O/c1-4-10-25(11-5-2)18-16-17(23-19(20)24-18)21-12-15(22-16)13-6-8-14(26-3)9-7-13/h6-9,15,22H,4-5,10-12H2,1-3H3,(H3,20,21,23,24)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.81E+5n/an/an/an/an/an/a



Sanofi-Aventis

Curated by ChEMBL


Assay Description
Inhibitory activity against human Nitric oxide synthase-II with 2 uM H4Bip for 30 min


J Med Chem 48: 4783-92 (2005)


Article DOI: 10.1021/jm050007x
BindingDB Entry DOI: 10.7270/Q28W3CTH
More data for this
Ligand-Target Pair