TDR Targets

Basic information

Technical information

TDR Targets ID: 886591
Name: 2-(4-fluorophenyl)-8-methoxy-3-(3-methoxyprop yl)chromeno[3,2-e]pyrimidine-4,5-dione
MW: 410.395 | Formula: C22H19FN2O5
H donors: 0 H acceptors: 2 LogP: 2.86 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: COCCCn1c(nc2c(c1=O)c(=O)c1c(o2)cc(cc1)OC)c1ccc(cc1)F
InChi: 1S/C22H19FN2O5/c1-28-11-3-10-25-20(13-4-6-14(23)7-5-13)24-21-18(22(25)27)19(26)16-9-8-15(29-2)12-17(16)30-21/h4-9,12H,3,10-11H2,1-2H3
InChiKey: FIJOXGUUHFGGBX-UHFFFAOYSA-N

Network

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Target Layer

Model Organisms

Species	Viewmode
Arabidopsis thaliana
Caenorhabditis elegans
Dictyostelium discoideum
Drosophila melanogaster
Escherichia coli
Homo sapiens
Mus musculus
Oryza sativa
Saccharomyces cerevisiae
Schmidtea mediterranea
Other organisms

TDR Pathogens:

Species	Viewmode
Brugia malayi
Chlamydia trachomatis
Echinococcus granulosus
Entamoeba histolytica
Echinococcus multilocularis
Giardia lamblia
Leishmania major
Loa Loa (eye worm)
Mycobacterium leprae
Mycobacterium tuberculosis
Mycobacterium ulcerans
Onchocerca volvulus
Plasmodium falciparum
Plasmodium vivax
Schistosoma mansoni
Trypanosoma brucei
Trypanosoma cruzi
Toxoplasma gondii
Treponema pallidum
Trichomonas vaginalis
Wolbachia endosymbiont of Brugia malayi

Other Pathogens:

Species	Viewmode
Babesia bovis
Candida albicans
Cryptosporidium hominis
Cryptosporidium parvum
Leishmania braziliensis
Leishmania donovani
Leishmania infantum
Leishmania mexicana
Neospora caninum
Plasmodium berghei
Plasmodium knowlesi
Plasmodium yoelii
Schistosoma japonicum
Trypanosoma brucei gambiense
Trypanosoma congolense
Theileria parva

Compound Layer

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Clustering layers

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Synonyms

2-(4-fluorophenyl)-8-methoxy-3-(3-methoxypropyl)chromeno[3,2-e]pyrimidine-4,5-quinone
ZINC02202784

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology

No druggable targets predicted by orthology data

By sequence similarity to non orthologous known druggable targets

No druggable targets predicted by sequence similarity

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Leishmania major	subtilisin-like serine peptidase	0.0106	0.0181	0.5
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0097	0.0141	0.0141
Trichomonas vaginalis	conserved hypothetical protein	0.0481	0.1832	0.3212
Plasmodium vivax	subtilisin-like serine protease, putative	0.0106	0.0181	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0481	0.1832	0.3212
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0613	0.2414	0.4232
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0106	0.0181	0.0317
Trichomonas vaginalis	conserved hypothetical protein	0.0481	0.1832	0.3212
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0106	0.0181	0.0317
Loa Loa (eye worm)	TK/EGFR protein kinase	0.0135	0.0309	0.0309
Echinococcus granulosus	membrane bound transcription factor site 1	0.0106	0.0181	0.0181
Brugia malayi	Membrane-bound transcription factor site-1 protease precursor	0.0106	0.0181	0.0181
Giardia lamblia	High cysteine membrane protein Group 2	0.0772	0.3116	1
Brugia malayi	proprotein convertase 2	0.1588	0.671	0.671
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0132	0.0295	0.0517
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0106	0.0181	0.0317
Mycobacterium ulcerans	membrane-anchored mycosin MycP3	0.0106	0.0181	0.5
Trypanosoma brucei	subtilisin peptidase	0.0106	0.0181	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0481	0.1832	0.3212
Echinococcus granulosus	Furin 1	0.0613	0.2414	0.2414
Plasmodium falciparum	subtilisin-like protease 3	0.0106	0.0181	0.5
Plasmodium falciparum	subtilisin-like protease 1	0.0106	0.0181	0.5
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0613	0.2414	0.4232
Schistosoma mansoni	site-1 peptidase (S08 family)	0.0106	0.0181	0.0181
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0106	0.0181	0.0317
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0106	0.0181	0.0317
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0613	0.2414	0.4232
Mycobacterium tuberculosis	Probable membrane-anchored mycosin MycP4 (serine protease) (subtilisin-like protease) (subtilase-like) (mycosin-4)	0.0106	0.0181	0.5
Mycobacterium leprae	PROBABLE PROLINE RICH MEMBRANE-ANCHORED MYCOSIN MYCP5 (SERINE PROTEASE) (SUBTILISIN-LIKE PROTEASE) (SUBTILASE-LIKE) (MYCOSIN-5)	0.0106	0.0181	0.5
Loa Loa (eye worm)	hypothetical protein	0.1001	0.4123	0.4123
Plasmodium vivax	subtilisin-like protease 1	0.0106	0.0181	0.5
Echinococcus granulosus	neuroendocrine convertase 2	0.1588	0.671	0.671
Trichomonas vaginalis	conserved hypothetical protein	0.0481	0.1832	0.3212
Trichomonas vaginalis	conserved hypothetical protein	0.0481	0.1832	0.3212
Trichomonas vaginalis	proprotein convertase subtilisin/kexin type, putative	0.0507	0.1945	0.3411
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0106	0.0181	0.0317
Echinococcus granulosus	wd40 repeat	0.0069	0.0019	0.0019
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0613	0.2414	0.4232
Schistosoma mansoni	tripeptidyl-peptidase II (S08 family)	0.0106	0.0181	0.0181
Loa Loa (eye worm)	proprotein convertase 2	0.0613	0.2414	0.2414
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0106	0.0181	0.0317
Brugia malayi	Subtilase family protein	0.0106	0.0181	0.0181
Mycobacterium tuberculosis	Probable proline rich membrane-anchored mycosin MycP5 (serine protease) (subtilisin-like protease) (subtilase-like) (mycosin-5)	0.0106	0.0181	0.5
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0106	0.0181	0.0317
Schistosoma mansoni	subfamily S8B non-peptidase homologue (S08 family)	0.0613	0.2414	0.2414
Mycobacterium leprae	PROBABLE MEMBRANE-ANCHORED MYCOSIN MYCP3 (SERINE PROTEASE) (SUBTILISIN-LIKE PROTEASE) (SUBTILASE-LIKE) (MYCOSIN-3)	0.0106	0.0181	0.5
Trichomonas vaginalis	leucine-rich repeat protein, BspA family	0.0481	0.1832	0.3212
Echinococcus multilocularis	Furin 1	0.0613	0.2414	0.3062
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0106	0.0181	0.0317
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0106	0.0181	0.0317
Brugia malayi	Hypothetical subtilase-type proteinase F21H12.6 in chromosome II	0.0106	0.0181	0.0181
Loa Loa (eye worm)	hypothetical protein	0.2334	1	1
Schistosoma mansoni	tyrosine kinase	0.0135	0.0309	0.0309
Onchocerca volvulus		0.0085	0.0089	0.494
Echinococcus multilocularis	neuroendocrine convertase 2	0.1588	0.671	0.8514
Mycobacterium ulcerans	membrane-anchored serine protease (mycosin), MycP4	0.0106	0.0181	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0069	0.0019	0.0033
Brugia malayi	celfurPC protein	0.1854	0.7881	0.7881
Brugia malayi	Furin-like cysteine rich region family protein	0.0135	0.0309	0.0309
Echinococcus granulosus	furin	0.2334	1	1
Plasmodium vivax	subtilisin-like protease 2, putative	0.0106	0.0181	0.5
Plasmodium falciparum	subtilisin-like protease 2	0.0106	0.0181	0.5
Trichomonas vaginalis	retinoblastoma binding protein, putative	0.0069	0.0019	0.0033
Trichomonas vaginalis	conserved hypothetical protein	0.0106	0.0181	0.0317
Trichomonas vaginalis	neuroendocrine convertase 2 precursor, putative	0.0507	0.1945	0.3411
Loa Loa (eye worm)	hypothetical protein	0.0069	0.0019	0.0019
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0106	0.0181	0.0317
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0106	0.0181	0.0317
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0106	0.0181	0.0317
Loa Loa (eye worm)	hypothetical protein	0.0189	0.0545	0.0545
Trypanosoma cruzi	serine peptidase, clan SB, family S8-like protein	0.0106	0.0181	0.5
Echinococcus granulosus	proprotein convertase subtilisin:kexin type 5	0.1359	0.5703	0.5703
Trichomonas vaginalis	conserved hypothetical protein	0.0481	0.1832	0.3212
Schistosoma mansoni	site-1 peptidase (S08 family)	0.0106	0.0181	0.0181
Trypanosoma cruzi	subtilisin-like serine peptidase, putative	0.0106	0.0181	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.0106	0.0181	0.0317
Trichomonas vaginalis	conserved hypothetical protein	0.0481	0.1832	0.3212
Echinococcus multilocularis	epidermal growth factor receptor	0.0135	0.0309	0.0392
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.1359	0.5703	1
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0106	0.0181	0.0317
Schistosoma mansoni	subfamily S8B unassigned peptidase (S08 family)	0.2334	1	1
Trichomonas vaginalis	conserved hypothetical protein	0.0481	0.1832	0.3212
Trichomonas vaginalis	hypothetical protein	0.0481	0.1832	0.3212
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0106	0.0181	0.0317
Trichomonas vaginalis	conserved hypothetical protein	0.0106	0.0181	0.0317
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0097	0.0141	0.0141
Echinococcus multilocularis		0.1854	0.7881	1
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0106	0.0181	0.0317
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0106	0.0181	0.0317
Echinococcus multilocularis	wd40 repeat	0.0069	0.0019	0.0024
Trichomonas vaginalis	conserved hypothetical protein	0.0106	0.0181	0.0317
Loa Loa (eye worm)	hypothetical protein	0.0097	0.0141	0.0141
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0106	0.0181	0.0317
Trypanosoma cruzi	subtilisin-like serine peptidase, putative	0.0106	0.0181	0.5
Loa Loa (eye worm)	subtilase	0.0106	0.0181	0.0181
Trypanosoma cruzi	subtilisin peptidase	0.0106	0.0181	0.5
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0106	0.0181	0.0317
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0613	0.2414	0.4232
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0106	0.0181	0.0317
Trichomonas vaginalis	conserved hypothetical protein	0.0106	0.0181	0.0317
Echinococcus granulosus	epidermal growth factor receptor	0.0135	0.0309	0.0309
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0106	0.0181	0.0317
Schistosoma mansoni	furin-1 (S08 family)	0.1081	0.4478	0.4478
Brugia malayi	Trypsin family protein	0.0097	0.0141	0.0141
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0106	0.0181	0.0317
Echinococcus multilocularis	Peptidase S8 S53, subtilisin kexin sedolisin	0.0106	0.0181	0.023
Schistosoma mansoni	hypothetical protein	0.0481	0.1832	0.1832
Loa Loa (eye worm)	hypothetical protein	0.0106	0.0181	0.0181
Brugia malayi	neuroendocrine convertase 1 precursor	0.1751	0.7428	0.7428
Echinococcus multilocularis	proprotein convertase subtilisin:kexin type 5	0.1359	0.5703	0.7237
Onchocerca volvulus		0.0106	0.0181	1
Toxoplasma gondii	subtilisin SUB12	0.0121	0.0248	1
Loa Loa (eye worm)	hypothetical protein	0.0097	0.0141	0.0141
Mycobacterium tuberculosis	Probable membrane-anchored mycosin MycP3 (serine protease) (subtilisin-like protease) (subtilase-like) (mycosin-3)	0.0106	0.0181	0.5
Mycobacterium ulcerans	proline rich membrane-anchored mycosin MycP5	0.0106	0.0181	0.5
Mycobacterium leprae	Possible secreted protease	0.0106	0.0181	0.5
Brugia malayi	Hypothetical WD-repeat protein F21H12.1 in chromosome II	0.0069	0.0019	0.0019
Trichomonas vaginalis	conserved hypothetical protein	0.0481	0.1832	0.3212
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.1359	0.5703	1
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0106	0.0181	0.0317
Schistosoma mansoni	retinoblastoma binding protein	0.0069	0.0019	0.0019
Trichomonas vaginalis	Clan SB, family S8, subtilisin-like serine peptidase	0.0613	0.2414	0.4232
Trypanosoma brucei	serine peptidase, clan SB, family S8-like protein	0.0106	0.0181	0.5
Loa Loa (eye worm)	endoprotease bli-4	0.2334	1	1
Schistosoma mansoni	subfamily S8B unassigned peptidase (S08 family)	0.0132	0.0295	0.0295
Onchocerca volvulus		0.0097	0.0141	0.7769
Echinococcus granulosus	peptidase s8 s53 subtilisin kexin sedolisin	0.0106	0.0181	0.0181
Mycobacterium tuberculosis	Probable alanine and proline rich membrane-anchored mycosin MycP2 (serine protease) (subtilisin-like protease) (subtilase-like)	0.0106	0.0181	0.5
Echinococcus multilocularis	membrane bound transcription factor site 1	0.0106	0.0181	0.023
Trichomonas vaginalis	conserved hypothetical protein	0.0481	0.1832	0.3212

Activities

No activities found for this compound.

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?

In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.

In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

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Bibliographic References

No literature references available for this target.

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Detailed information for compound 886591