BDBM50065805 CHEMBL544788::N-(3-Aminomethyl-benzyl)-acetamidine

SMILES CC(=N)NCc1cccc(CN)c1

InChI Key InChIKey=RODUKNYOEVZQPR-UHFFFAOYSA-N

Data  3 KI

PDB links: 3 PDB IDs match this monomer.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50065805   

TargetNitric oxide synthase, inducible(Human)
Glaxo Wellcome Research and Development

Curated by ChEMBL
LigandPNGBDBM50065805(N-(3-Aminomethyl-benzyl)-acetamidine | CHEMBL54478...)
Affinity DataKi:  140nMAssay Description:Inhibitory activity against human inducible nitric oxide synthase (iNOS) isoenzyme.More data for this Ligand-Target Pair
In DepthDetails Article
PubMedPDB3D3D Structure (crystal)
TargetNitric oxide synthase, brain(Human)
Glaxo Wellcome Research and Development

Curated by ChEMBL
LigandPNGBDBM50065805(N-(3-Aminomethyl-benzyl)-acetamidine | CHEMBL54478...)
Affinity DataKi:  2.00E+3nMAssay Description:Inhibitory activity against human neuronal nitric oxide synthase (nNOS) isoenzyme.More data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetNitric oxide synthase, endothelial(Human)
Glaxo Wellcome Research and Development

Curated by ChEMBL
LigandPNGBDBM50065805(N-(3-Aminomethyl-benzyl)-acetamidine | CHEMBL54478...)
Affinity DataKi:  7.50E+4nMAssay Description:Inhibitory activity against human endothelial nitric oxide synthase (eNOS) isoenzyme.More data for this Ligand-Target Pair
In DepthDetails Article
PubMedPDB3D3D Structure (crystal)