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PubMed code 11784131

Compile data set for download or QSAR
Found 2 hits of Enzyme Inhibition Constant Data   
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


(Rattus norvegicus (rat))
BDBM50108560
PNG
(2-Acetylamino-4-(2-amino-5-methoxy-phenyl)-4-oxo-b...)
Show SMILES COc1ccc(N)c(c1)C(=O)CC(NC(C)=O)C(O)=O
Show InChI InChI=1S/C13H16N2O5/c1-7(16)15-11(13(18)19)6-12(17)9-5-8(20-2)3-4-10(9)14/h3-5,11H,6,14H2,1-2H3,(H,15,16)(H,18,19)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 4.10E+4n/an/an/an/an/an/a



Universidad de Granada

Curated by ChEMBL


Assay Description
50% inhibitory concentration against Neuronal nitric oxide synthase (nNOS) activity


J Med Chem 45: 263-74 (2002)


Article DOI: 10.1021/jm010916w
BindingDB Entry DOI: 10.7270/Q2474966
More data for this
Ligand-Target Pair
Nitric-oxide synthase, brain


(Rattus norvegicus (rat))
BDBM50108561
PNG
(4-(2-Amino-5-methoxy-phenyl)-2-butyrylamino-4-oxo-...)
Show SMILES CCCC(=O)NC(CC(=O)c1cc(OC)ccc1N)C(O)=O
Show InChI InChI=1S/C15H20N2O5/c1-3-4-14(19)17-12(15(20)21)8-13(18)10-7-9(22-2)5-6-11(10)16/h5-7,12H,3-4,8,16H2,1-2H3,(H,17,19)(H,20,21)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+6n/an/an/an/an/an/a



Universidad de Granada

Curated by ChEMBL


Assay Description
50% inhibitory concentration against Neuronal nitric oxide synthase (nNOS) activity


J Med Chem 45: 263-74 (2002)


Article DOI: 10.1021/jm010916w
BindingDB Entry DOI: 10.7270/Q2474966
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%