Details of the Drug-Related molecule(s) Interaction Atlas

General Information of Drug (ID: DMT9WPJ)

Drug Name

WR-089120 Drug Info

Synonyms

1-(3-nitrophenyl)-3-phenylprop-2-en-1-one; 16619-21-9; 3'-Nitrochalcone; CHEMBL187682; WR-089120; NSC186962; AC1NWTRO; (2E)-1-(3-nitrophenyl)-3-phenylprop-2-en-1-one; 2-Propen-1-one, 1-(3-nitrophenyl)-3-phenyl-; SCHEMBL9779522; DTXSID60420806; MolPort-000-653-504; ZINC4159317; BDBM50154604; SBB055406; 5324AD; AKOS002346621; NSC-186962; ACM16619219; KB-147050; (E)-1-(3-Nitro-phenyl)-3-phenyl-propenone

Indication

Disease Entry	ICD 11	Status	REF
Discovery agent	N.A.	Investigative	[1]

Cross-matching ID

PubChem CID: 5712110
CAS Number: CAS 16619-21-9
TTD Drug ID: DMT9WPJ

Molecule-Related Drug Atlas

Molecule Type:

DTT

Drug Status:

Patented Agent(s)

Investigative Drug(s)

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Drug(s) Targeting Plasmodium CDK Pfmrk (Malaria Pfmrk)

Drug Name	Drug ID	Indication	ICD 11	Highest Status	REF
KENPAULLONE	DMAGVXW	Discovery agent	N.A.	Patented	[2]
APIGENIN	DMI3491	Discovery agent	N.A.	Investigative	[2]
2,5-dichloro-N-p-tolylthiophene-3-sulfonamide	DMU5J8Y	Discovery agent	N.A.	Investigative	[3]
WR-289010	DMS2QUL	Discovery agent	N.A.	Investigative	[1]
WR-080539	DMUCGK8	Discovery agent	N.A.	Investigative	[1]
5-chloro-4-nitrothiophene-2-sulfonamide	DMRS82Q	Discovery agent	N.A.	Investigative	[3]
Oxindole derivative	DM1AU8V	Malaria	1F40-1F45	Investigative	[4]
WR-203581	DM9M1UO	Discovery agent	N.A.	Investigative	[1]
WR-289009	DM5W9GR	Discovery agent	N.A.	Investigative	[1]
N-(2-aminoethyl)isoquinoline-5-sulfonamide	DMG2MSX	Discovery agent	N.A.	Investigative	[5]
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Molecular Interaction Atlas of This Drug

Molecular Interaction Atlas

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Drug Therapeutic Target (DTT)

DTT Name	DTT ID	UniProt ID	MOA	REF
Plasmodium CDK Pfmrk (Malaria Pfmrk)	TTSFWA7	P90584_PLAFA	Inhibitor	[1]

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References

1	Selective inhibition of Pfmrk, a Plasmodium falciparum CDK, by antimalarial 1,3-diaryl-2-propenones. Bioorg Med Chem Lett. 2009 Apr 1;19(7):1982-5.
2	A three-dimensional in silico pharmacophore model for inhibition of Plasmodium falciparum cyclin-dependent kinases and discovery of different class... J Med Chem. 2004 Oct 21;47(22):5418-26.
3	Activity of substituted thiophene sulfonamides against malarial and mammalian cyclin dependent protein kinases, Bioorg. Med. Chem. Lett. 20(13):3863-3867 (2010).
4	Novel molecular targets for antimalarial chemotherapy. Int J Antimicrob Agents. 2007 Jul;30(1):4-10.
5	Evaluation of broad spectrum protein kinase inhibitors to probe the architecture of the malarial cyclin dependent protein kinase Pfmrk. Bioorg Med Chem Lett. 2007 Sep 1;17(17):4961-6.