Literature summary for 3.4.23.39 extracted from

Rasina, D.; Otikovs, M.; Leitans, J.; Recacha, R.; Borysov, O.V.; Kanepe-Lapsa, I.; Domraceva, I.; Pantelejevs, T.; Tars, K.; Blackman, M.J.; Jaudzems, K.; Jirgensons, A.
Fragment-based discovery of 2-aminoquinazolin-4(3H)-ones as novel class nonpeptidomimetic inhibitors of the plasmepsins I, II, and IV (2016), J. Med. Chem., 59, 374-387 .

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Inhibitors

Inhibitors	Comment	Organism	Structure
(2E)-2-[(2H-1,3-benzodioxol-5-yl)methylidene]hydrazine-1-carboximidamide	-	Plasmodium falciparum
1-(diphenylmethyl)azetidin-3-ol	-	Plasmodium falciparum
1-amino-3-(4-nitroanilino)propan-2-ol	-	Plasmodium falciparum
1-phenyl-N-(propan-2-yl)methanesulfonamide	-	Plasmodium falciparum
2-amino-3-[(oxolan-2-yl)methyl]quinazolin-4(3H)-one	-	Plasmodium falciparum
2-amino-7-(4-butylphenyl)-3-[(5-phenyltetrahydrofuran-2-yl)methyl]quinazolin-4(3H)-one	-	Plasmodium falciparum
2-amino-7-(4-pentylphenyl)-3-[(5-phenyltetrahydrofuran-2-yl)methyl]quinazolin-4(3H)-one	-	Plasmodium falciparum
2-amino-7-phenyl-3-(tetrahydrofuran-2-ylmethyl)quinazolin-4(3H)-one	-	Plasmodium falciparum
2-amino-7-phenyl-3-[(5-phenyltetrahydrofuran-2-yl)methyl]quinazolin-4(3H)-one	-	Plasmodium falciparum
2-amino-7-[4-(4-phenylbutyl)phenyl]-3-[(5-phenyltetrahydrofuran-2-yl)methyl]quinazolin-4(3H)-one	-	Plasmodium falciparum
4-(1,2-benzothiazol-3-yl)-N-methylpiperazine-1-carboxamide	-	Plasmodium falciparum
4-(imidazo[2,1-b][1,3]thiazol-6-yl)aniline	-	Plasmodium falciparum
5-methyl-N3-phenyl-1H-pyrazole-3,4-diamine	-	Plasmodium falciparum
LV-928	-	Plasmodium falciparum
N-(2,5-dimethyl-1H-pyrrol-1-yl)-4-hydroxybenzamide	-	Plasmodium falciparum
N-(3-carbamoylthiophen-2-yl)thiophene-2-carboxamide	-	Plasmodium falciparum
pepstatin A	-	Plasmodium falciparum
TCMDC-134674	-	Plasmodium falciparum

Natural Substrates/ Products (Substrates)

Natural Substrates	Organism	Comment (Nat. Sub.)	Natural Products	Comment (Nat. Pro.)	Rev.	Reac.
Hemoglobin + H2O	Plasmodium falciparum	-	?	-	?

Organism

Organism	UniProt	Comment	Textmining
Plasmodium falciparum	P46925	isolate 3D7	-

Substrates and Products (Substrate)

Substrates	Comment Substrates	Organism	Products	Comment (Products)	Rev.	Reac.
Hemoglobin + H2O	-	Plasmodium falciparum	?	-	?

Synonyms

Synonyms	Comment	Organism
PLm II	-	Plasmodium falciparum

IC50 Value

IC50 Value	IC50 Value Maximum	Comment	Organism	Inhibitor	Structure
0.0243	-	pH and temperature not specified in the publication	Plasmodium falciparum	2-amino-3-[(oxolan-2-yl)methyl]quinazolin-4(3H)-one
0.094	-	pH and temperature not specified in the publication	Plasmodium falciparum	N-(2,5-dimethyl-1H-pyrrol-1-yl)-4-hydroxybenzamide
0.1	-	pH and temperature not specified in the publication	Plasmodium falciparum	N-(3-carbamoylthiophen-2-yl)thiophene-2-carboxamide
0.125	-	pH and temperature not specified in the publication	Plasmodium falciparum	1-amino-3-(4-nitroanilino)propan-2-ol
0.15	-	pH and temperature not specified in the publication	Plasmodium falciparum	(2E)-2-[(2H-1,3-benzodioxol-5-yl)methylidene]hydrazine-1-carboximidamide
0.15	-	pH and temperature not specified in the publication	Plasmodium falciparum	4-(imidazo[2,1-b][1,3]thiazol-6-yl)aniline
0.152	-	pH and temperature not specified in the publication	Plasmodium falciparum	5-methyl-N3-phenyl-1H-pyrazole-3,4-diamine
0.184	-	pH and temperature not specified in the publication	Plasmodium falciparum	4-(1,2-benzothiazol-3-yl)-N-methylpiperazine-1-carboxamide
0.196	-	pH and temperature not specified in the publication	Plasmodium falciparum	1-(diphenylmethyl)azetidin-3-ol
0.2	-	pH and temperature not specified in the publication	Plasmodium falciparum	1-phenyl-N-(propan-2-yl)methanesulfonamide

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Release 2023.1 (January 2023)