Chemical Information
Antiviral agent ID	DrugRepV_8477
Antiviral agent name	Chelerythrine chloride
IUPAC Name	1,2-dimethoxy-12-methyl-[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium;chloride
SMILES (canonical)	C[N+]1=C2C(=C3C=CC(=C(C3=C1)OC)OC)C=CC4=CC5=C(C=C42)OCO5.[Cl-]
Molecular Formula	C21H18ClNO4
Molecular Weight (g/mol)	383.8
InChl	InChI=1S/C21H18NO4.ClH/c1-22-10-16-13(6-7-17(23-2)21(16)24-3)14-5-4-12-8-18-19(26-11-25-18)9-15(12)20(14)22;/h4-10H,11H2,1-3H3;1H/q+1;/p-1
Common Name	Chelerythrinechloride
Synonyms	1,2-Dimethoxy-12-methyl-[1,3]dioxolo[4',5':4,5]benzo[1,2-c]phenanthridin-12-ium chloride | 3895-92-9 | UNII-7IC98TZ0PZ
Structural Information
Clinical Information
Biological Information
Secondary Indication	Human immunodeficiency virus (HIV) NA NA
Secondary Indication (Approaches)	Experimental
Secondary Indication (Methods)	In-vitro
Secondary Indication (Mode of drug delivery)	Culture
Secondary Indication (Drug concentration)	0.03 μM
Secondary Indication (Change)	Decrease
Secondary Indication (Type of Inhibition)	IC50 [ 50 % ]
Reference	Thomas AG, Rojas C, Tanega C, Shen M, Simeonov A, Boxer MB, Auld DS, Ferraris DV, Tsukamoto T, Slusher BS..Kinetic characterization of ebselen, chelerythrine and apomorphine as glutaminase inhibitors..Biochem Biophys Res Commun. 2013 Aug 23;438(2):243-8. doi: 10.1016/j.bbrc.2013.06.110. Epub 2013 Jul PMID:23850693
Comment	The newly identified inhibitors exhibited 10 to 1500-fold greater affinities than DON and BPTES and over 100-fold increased efficiency of inhibition.