BDBM50294112 1-(5-aminopentyl)-3-(3-methylbut-2-enyl)guanidine::CHEMBL495424::N-(gamma,gamma-Dimethylallyl)-N-(5-aminopentyl)-guanidine
SMILES: [#6]\[#6](-[#6])=[#6]\[#6]-[#7]-[#6](-[#7])=[#7]-[#6]-[#6]-[#6]-[#6]-[#6]-[#7]
InChI Key: InChIKey=VRMFKTMYYBSTQS-UHFFFAOYSA-N
Data: 1 KI
Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Polyamine oxidase 1 (Zea mays) | BDBM50294112 (1-(5-aminopentyl)-3-(3-methylbut-2-enyl)guanidine ...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 10 | n/a | n/a | n/a | n/a | n/a | n/a | 6.5 | n/a |
Universit£ degli Studi di Siena Curated by ChEMBL | Assay Description Inhibition of maize PAO at pH 6.5 by spectrophotometry-based Dixon plot method | J Med Chem 52: 4774-85 (2009) Article DOI: 10.1021/jm900371z BindingDB Entry DOI: 10.7270/Q2TB16W1 | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (docked) |