TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 334.365 | Formula: C21H18O4
H donors: 2 H acceptors: 4 LogP: 4.22 Rotable bonds: 7
Rule of 5 violations (Lipinski): 1
SMILES: OC(=O)C/C(=C(\C=C\c1ccccc1)/O)/C(=O)/C=C/c1ccccc1
InChi: 1S/C21H18O4/c22-19(13-11-16-7-3-1-4-8-16)18(15-21(24)25)20(23)14-12-17-9-5-2-6-10-17/h1-14,22H,15H2,(H,24,25)/b13-11+,14-12+,19-18-
InChiKey: LURXIDAHVUUJBT-BGFYTHSWSA-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

No synonyms found for this compound

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
Schistosoma mansoni	hypothetical protein	0.0032	0.066	0.0538
Loa Loa (eye worm)	hypothetical protein	0.0054	0.1301	0.1805
Trypanosoma cruzi	STE group serine/threonine-protein kinase, putative	0.0013	0.0076	0.0609
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0032	0.066	0.0589
Onchocerca volvulus		0.0049	0.1153	0.1579
Echinococcus multilocularis	expressed protein	0.0034	0.0709	0.0638
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.0031	0.0614	0.0492
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0015	0.015	0.0135
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0482	0.0598
Loa Loa (eye worm)	phosphatidylinositol 3	0.0046	0.1061	0.1452
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0046	0.1077	0.1009
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0034	0.071	0.0954
Echinococcus granulosus	death domain containing protein	0.0015	0.0129	0.0053
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0063	0.1571	0.1461
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0046	0.1077	0.1409
Mycobacterium tuberculosis	Probable aldehyde dehydrogenase	0.0062	0.1543	0.5
Leishmania major	phosphatidylinositol 3-kinase, putative	0.0015	0.015	0.0972
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0034	0.071	0.0954
Entamoeba histolytica	FKBP-rapamycin associated protein (FRAP), putative	0.0046	0.1061	0.1624
Trypanosoma cruzi	phosphatidylinositol 3-related kinase, putative	0.0015	0.015	0.1204
Onchocerca volvulus		0.0241	0.6897	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0025	0.0429	0.0543
Trypanosoma cruzi	PAB1-binding protein , putative	0.0052	0.1245	1
Echinococcus multilocularis	aldehyde dehydrogenase, mitochondrial	0.0062	0.1543	0.1478
Trichomonas vaginalis	adenylate and guanylate cyclases, putative	0.0013	0.0076	0.0026
Trypanosoma brucei	Phosphatidylinositol 3-kinase tor1	0.0046	0.1061	0.8524
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0046	0.1077	0.1009
Leishmania major	PAS-domain containing phosphoglycerate kinase, putative	0.0013	0.0076	0.0492
Leishmania major	protein kinase, putative	0.0013	0.0076	0.0492
Schistosoma mansoni	lamin	0.0055	0.1331	0.1218
Echinococcus multilocularis	nuclear factor of activated T cells 5	0.0075	0.1937	0.1876
Entamoeba histolytica	hypothetical protein	0.0035	0.075	0.0281
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0452	0.0554
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0056	0.1374	0.8902
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0037	0.0781	0.1058
Trypanosoma cruzi	PAS-domain containing phosphoglycerate kinase, putative	0.0013	0.0076	0.0609
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0055	0.1331	0.1849
Echinococcus multilocularis	Ataxin 2, N terminal,domain containing protein	0.0023	0.0388	0.0314
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0103	0.2757	0.3903
Trypanosoma cruzi	STE/STE11 serine/threonine-protein kinase, putative	0.0013	0.0076	0.0609
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0032	0.066	0.0789
Brugia malayi	hypothetical protein	0.024	0.6862	1
Brugia malayi	PAS domain containing protein	0.005	0.1175	0.1553
Onchocerca volvulus		0.0031	0.0614	0.079
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0025	0.0431	0.0545
Onchocerca volvulus		0.0055	0.1331	0.184
Trichomonas vaginalis	rotamase, putative	0.0033	0.0685	0.0918
Onchocerca volvulus	Netrin receptor homolog	0.0015	0.0129	0.0078
Schistosoma mansoni	ataxia telangiectasia mutated (atm)-related	0.0046	0.1061	0.0945
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0032	0.066	0.0589
Echinococcus granulosus	expressed protein	0.0034	0.0709	0.0638
Onchocerca volvulus		0.0055	0.1331	0.184
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0025	0.0431	0.0545
Loa Loa (eye worm)	hypothetical protein	0.024	0.6862	1
Entamoeba histolytica	hypothetical protein	0.0111	0.3001	1
Schistosoma mansoni	intermediate filament proteins	0.0055	0.1331	0.1218
Trichomonas vaginalis	guanylate cyclase, putative	0.0013	0.0076	0.0026
Chlamydia trachomatis	two component regulatory system sensor histidine kinase	0.0013	0.0076	0.5
Giardia lamblia	GTOR	0.0046	0.1061	0.5
Schistosoma mansoni	hypothetical protein	0.0032	0.066	0.0538
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0025	0.0429	0.0543
Trichomonas vaginalis	conserved hypothetical protein	0.0035	0.075	0.1013
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.0031	0.0614	0.0543
Brugia malayi	hypoxia-induced factor 1	0.0154	0.4285	0.6172
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor1	0.0046	0.1061	0.8524
Schistosoma mansoni	retinoblastoma-binding protein 4 (rbbp4)	0.0015	0.0133	0.0004
Brugia malayi	Pin1-type peptidyl-prolyl cis-trans isomerase, BmPin1	0.0034	0.0709	0.0862
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0025	0.0431	0.0545
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0133	0.0083
Schistosoma mansoni	transcription factor LCR-F1	0.0111	0.3001	0.291
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0029	0.0561	0.0715
Plasmodium vivax	basic transcription factor 3b, putative	0.0035	0.075	0.2156
Echinococcus granulosus	nuclear factor of activated T cells 5	0.0075	0.1937	0.1876
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0046	0.1077	0.0961
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0037	0.0781	0.1058
Echinococcus granulosus	netrin receptor unc 5	0.0015	0.0129	0.0053
Entamoeba histolytica	hypothetical protein	0.0111	0.3001	1
Schistosoma mansoni	hypothetical protein	0.0345	1	1
Echinococcus multilocularis	cytoplasmic intermediate filament protein	0.0027	0.0482	0.0409
Echinococcus granulosus	ankyrin repeat and death domain containing protein	0.0015	0.0129	0.0053
Onchocerca volvulus		0.0037	0.0789	0.1045
Schistosoma mansoni	ankyrin 23/unc44	0.0015	0.0129	0.000000064185
Loa Loa (eye worm)	phosphatidylinositol 3	0.0015	0.015	0.0109
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0034	0.071	0.0954
Schistosoma mansoni	transcription factor btf3	0.0035	0.075	0.063
Schistosoma mansoni	cpg binding protein	0.0031	0.0611	0.0488
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0046	0.1061	0.1385
Brugia malayi	Pre-SET motif family protein	0.0031	0.0614	0.0721
Loa Loa (eye worm)	hypothetical protein	0.007	0.1786	0.2521
Leishmania major	target of rapamycin kinase (TOR) kinase 3	0.0037	0.0782	0.5068
Schistosoma mansoni	cpg binding protein	0.0031	0.0611	0.0488
Loa Loa (eye worm)	hypothetical protein	0.0103	0.2757	0.395
Trichomonas vaginalis	conserved hypothetical protein	0.0013	0.0076	0.0026
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.0031	0.0614	0.3982
Trichomonas vaginalis	conserved hypothetical protein	0.0013	0.0076	0.0026
Echinococcus granulosus	Ankyrin	0.0015	0.0133	0.0057
Leishmania major	hypothetical protein, conserved	0.0052	0.1245	0.8071
Plasmodium falciparum	ataxin-2 like protein, putative	0.0052	0.1245	1
Toxoplasma gondii	NAC domain-containing protein	0.0035	0.075	0.4864
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0032	0.066	0.0589
Leishmania major	protein kinase, putative	0.0013	0.0076	0.0492
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0037	0.0781	0.1058
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0037	0.0781	0.1058
Trichomonas vaginalis	conserved hypothetical protein	0.0035	0.075	0.1013
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0103	0.2757	0.395
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0046	0.1061	0.1468
Trichomonas vaginalis	adenylate and guanylate cyclases, putative	0.0013	0.0076	0.0026
Echinococcus multilocularis	musashi	0.0055	0.1331	0.1265
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0046	0.1061	0.1468
Echinococcus multilocularis	transcription factor btf3	0.0035	0.075	0.068
Wolbachia endosymbiont of Brugia malayi	parvulin-like peptidyl-prolyl isomerase, PPID	0.001	0	0.5
Schistosoma mansoni	survival motor neuron protein	0.0049	0.1153	0.1037
Brugia malayi	Protein kinase domain containing protein	0.0015	0.0129	0.000000094102
Trypanosoma brucei	FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative	0.0019	0.026	0.2085
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0039	0.0861	0.1175
Schistosoma mansoni	hypothetical protein	0.007	0.1786	0.1679
Leishmania major	basic transcription factor 3a, putative	0.0035	0.075	0.4864
Schistosoma mansoni	aldehyde dehydrogenase	0.0062	0.1543	0.1433
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0032	0.066	0.0589
Trypanosoma cruzi	transcription factor btf3, putative	0.0035	0.075	0.6026
Schistosoma mansoni	hypothetical protein	0.0345	1	1
Schistosoma mansoni	hypothetical protein	0.0032	0.066	0.0538
Echinococcus granulosus	histone lysine methyltransferase setb	0.0031	0.0614	0.0543
Trypanosoma brucei	PAB1-binding protein , putative	0.0052	0.1245	1
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0046	0.1077	0.0961
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0031	0.061	0.0807
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0031	0.0614	0.0543
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0032	0.066	0.0861
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0031	0.0614	0.0492
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0027	0.051	0.0661
Echinococcus granulosus	intermediate filament protein	0.0055	0.1331	0.1265
Loa Loa (eye worm)	cytoplasmic intermediate filament protein	0.0029	0.0569	0.0727
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0034	0.071	0.0954
Brugia malayi	hypothetical protein	0.0052	0.1245	0.1658
Echinococcus multilocularis	survival motor neuron protein 1	0.024	0.6862	0.6838
Echinococcus multilocularis	netrin receptor unc 5	0.0015	0.0129	0.0053
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0614	0.0794
Loa Loa (eye worm)	hypoxia-induced factor 1	0.0154	0.4285	0.6202
Brugia malayi	Pre-SET motif family protein	0.0212	0.6021	0.8751
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0103	0.2757	0.3903
Onchocerca volvulus		0.0029	0.0561	0.0711
Schistosoma mansoni	aryl hydrocarbon receptor	0.005	0.1175	0.1059
Echinococcus multilocularis	GPCR, family 2	0.0032	0.066	0.0589
Brugia malayi	Death domain containing protein	0.0015	0.0129	0.000000094102
Leishmania major	peptidyl-prolyl cis-trans isomerase/rotamase, putative,PPIase, putative	0.0033	0.0685	0.4442
Entamoeba histolytica	hypothetical protein	0.0111	0.3001	1
Trichomonas vaginalis	conserved hypothetical protein	0.0013	0.0076	0.0026
Loa Loa (eye worm)	hypothetical protein	0.0032	0.066	0.0861
Trichomonas vaginalis	rotamase, putative	0.0034	0.0709	0.0953
Echinococcus granulosus	FKBP12 rapamycin complex associated protein	0.0046	0.1061	0.0993
Trypanosoma cruzi	target of rapamycin kinase 3	0.0037	0.0782	0.628
Leishmania major	target of rapamycin (TOR) kinase 1, putative	0.0046	0.1061	0.6879
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0046	0.1077	0.0961
Trypanosoma brucei	phosphatidylinositol 3-kinase, putative	0.0015	0.015	0.1204
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0037	0.0781	0.1058
Trypanosoma brucei	phosphatidylinositol 3-kinase tor, putative	0.0022	0.0339	0.2719
Leishmania major	target of rapamycin (TOR) kinase 2, putative	0.0046	0.1061	0.6879
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0034	0.071	0.0954
Echinococcus multilocularis	FKBP12 rapamycin complex associated protein	0.0046	0.1061	0.0993
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0025	0.0429	0.0543
Trichomonas vaginalis	conserved hypothetical protein	0.0035	0.075	0.1013
Echinococcus granulosus	GPCR family 2	0.0032	0.066	0.0589
Echinococcus granulosus	lamin	0.0055	0.1331	0.1265
Brugia malayi	Intermediate filament tail domain containing protein	0.0055	0.1331	0.1785
Schistosoma mansoni	hypothetical protein	0.0049	0.1153	0.1037
Trypanosoma cruzi	transcription factor btf3, putative	0.0035	0.075	0.6026
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0062	0.1543	1
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0212	0.6021	0.8761
Trypanosoma cruzi	STE/STE11 serine/threonine-protein kinase, putative	0.0013	0.0076	0.0609
Trichomonas vaginalis	soluble guanylate cyclase gcy, putative	0.0013	0.0076	0.0026
Brugia malayi	Uncoordinated protein 44	0.0015	0.0129	0.000000094102
Echinococcus granulosus	phosphatidylinositol 3 and 4 kinase	0.0015	0.015	0.0075
Trypanosoma cruzi	PAB1-binding protein , putative	0.0052	0.1245	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0015	0.015	0.0135
Schistosoma mansoni	aldehyde dehydrogenase	0.0062	0.1543	0.1433
Schistosoma mansoni	single-minded	0.005	0.1175	0.1059
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0046	0.1077	0.1009
Echinococcus multilocularis	cpg binding protein	0.0031	0.0611	0.0539
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0034	0.071	0.0954
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0031	0.0614	0.0492
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0027	0.051	0.0661
Loa Loa (eye worm)	Pin1-type peptidyl-prolyl cis-trans isomerase	0.0034	0.0709	0.0933
Trypanosoma cruzi	peptidyl-prolyl cis-trans isomerase	0.0033	0.0685	0.5503
Echinococcus granulosus	survival motor neuron protein 1	0.024	0.6862	0.6838
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0046	0.1077	0.1009
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0025	0.0431	0.0545
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0015	0.015	0.0135
Trichomonas vaginalis	adenylate cyclase, type VII, putative	0.0013	0.0076	0.0026
Trichomonas vaginalis	adenylate and guanylate cyclases, putative	0.0013	0.0076	0.0026
Trichomonas vaginalis	conserved hypothetical protein	0.0034	0.0709	0.0953
Entamoeba histolytica	hypothetical protein	0.0111	0.3001	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0015	0.015	0.0135
Loa Loa (eye worm)	hypothetical protein	0.0052	0.1245	0.1723
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0062	0.1543	1
Brugia malayi	beta-NAC-like protein	0.0035	0.075	0.0923
Echinococcus granulosus	cytoplasmic intermediate filament protein	0.0027	0.0482	0.0409
Loa Loa (eye worm)	hypothetical protein	0.0167	0.467	0.6771
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0046	0.1077	0.1476
Brugia malayi	bHLH-PAS transcription factor	0.0037	0.0789	0.098
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0111	0.3001	0.2947
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0027	0.0501	0.0649
Entamoeba histolytica	phosphatidylinositol3-kinaseTor2, putative	0.0046	0.1061	0.1624
Echinococcus multilocularis	geminin	0.0345	1	1
Echinococcus multilocularis	lamin	0.0055	0.1331	0.1265
Schistosoma mansoni	phosphatidylinositol 3-and 4-kinase	0.0015	0.015	0.0021
Brugia malayi	Iron-sulfur cluster assembly accessory protein	0.0049	0.1153	0.1521
Schistosoma mansoni	hypothetical protein	0.0111	0.3001	0.291
Echinococcus multilocularis	Ankyrin	0.0015	0.0133	0.0057
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0027	0.051	0.0661
Toxoplasma gondii	target of rapamycin (TOR), putative	0.0034	0.071	0.4602
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0031	0.0614	0.0492
Plasmodium vivax	ataxin-2 like protein, putative	0.0052	0.1245	1
Schistosoma mansoni	lamin	0.0055	0.1331	0.1218
Trichomonas vaginalis	adenylate cyclase, putative	0.0013	0.0076	0.0026
Leishmania major	aldehyde dehydrogenase, mitochondrial precursor	0.0062	0.1543	1
Echinococcus granulosus	cpg binding protein	0.0031	0.0611	0.0539
Toxoplasma gondii	peptidylprolyl isomerase	0.0033	0.0685	0.4442
Leishmania major	phosphatidylinositol 3-related kinase, putative	0.0015	0.015	0.0972
Echinococcus granulosus	aldehyde dehydrogenase mitochondrial	0.0062	0.1543	0.1478
Echinococcus multilocularis	phosphatidylinositol 3 and 4 kinase	0.0015	0.015	0.0075
Trypanosoma brucei	transcription factor BTF3, putative	0.0035	0.075	0.6026
Echinococcus granulosus	single minded 2	0.0037	0.0789	0.0718
Trypanosoma brucei	target of rapamycin kinase 3, putative	0.0037	0.0782	0.628
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0015	0.015	0.0135
Loa Loa (eye worm)	intermediate filament protein	0.0055	0.1331	0.1849
Echinococcus multilocularis	ankyrin repeat and death domain containing protein	0.0015	0.0129	0.0053
Brugia malayi	Cytochrome P450 family protein	0.0046	0.1071	0.1399
Loa Loa (eye worm)	cytochrome P450 family protein	0.0046	0.1071	0.1466
Toxoplasma gondii	LsmAD domain-containing protein	0.0052	0.1245	0.8071
Echinococcus granulosus	lamin dm0	0.0055	0.1331	0.1265
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0452	0.0554
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0129	0.0078
Loa Loa (eye worm)	ICD-1 protein	0.0035	0.075	0.0994
Echinococcus granulosus	transcription factor btf3	0.0035	0.075	0.068
Schistosoma mansoni	rotamase	0.0034	0.0709	0.0588
Echinococcus multilocularis	transfer RNA-Lys	0.0037	0.0789	0.0718
Schistosoma mansoni	cpg binding protein	0.0029	0.0561	0.0438
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0015	0.015	0.0031
Entamoeba histolytica	transcription factor BTF3, putative	0.0035	0.075	0.0281
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0034	0.071	0.0954
Echinococcus multilocularis	lamin dm0	0.0055	0.1331	0.1265
Mycobacterium leprae	Possible regulatory protein	0.0013	0.0076	0.5
Schistosoma mansoni	hypothetical protein	0.0023	0.0388	0.0262
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0027	0.0501	0.0649
Brugia malayi	cytoplasmic intermediate filament protein	0.0029	0.0569	0.0654
Toxoplasma gondii	aldehyde dehydrogenase	0.0062	0.1543	1
Trypanosoma cruzi	peptidyl-prolyl cis-trans isomerase	0.0033	0.0685	0.5503
Brugia malayi	hypothetical protein	0.0167	0.467	0.6745
Trichomonas vaginalis	set domain proteins, putative	0.0241	0.6893	1
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0111	0.3001	0.2947
Plasmodium falciparum	ataxin-2 like protein, putative	0.0052	0.1245	1
Loa Loa (eye worm)	immunoglobulin I-set domain-containing protein	0.0015	0.0129	0.0078
Trypanosoma brucei	peptidyl-prolyl cis-trans isomerase/rotamase, putative	0.0033	0.0685	0.5503
Brugia malayi	intermediate filament protein	0.0055	0.1331	0.1785
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor2	0.0046	0.1061	0.8524
Brugia malayi	Latrophilin receptor protein 2	0.0032	0.066	0.0789
Brugia malayi	hypothetical protein	0.0111	0.3001	0.4266
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0062	0.1543	1
Loa Loa (eye worm)	hypothetical protein	0.0055	0.1331	0.1849
Echinococcus granulosus	Ataxin 2 N terminaldomain containing protein	0.0023	0.0388	0.0314
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0046	0.1061	0.1468
Trypanosoma brucei	phosphatidylinositol 3-related kinase, putative	0.0015	0.015	0.1204
Brugia malayi	hypothetical protein	0.0034	0.0694	0.084
Trypanosoma brucei	phosphatidylinositol 4-kinase, putative	0.0046	0.1061	0.8524
Trypanosoma cruzi	phosphatidylinositol 3-related kinase, putative	0.0015	0.015	0.1204
Schistosoma mansoni	hypothetical protein	0.0105	0.2837	0.2743
Brugia malayi	CXXC zinc finger family protein	0.0029	0.0561	0.0642
Brugia malayi	latrophilin 2 splice variant baaae	0.007	0.1786	0.2462
Trichomonas vaginalis	PIKK family atypical protein kinase	0.003	0.058	0.0764
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.0029	0.0562	0.049
Trichomonas vaginalis	guanylate cyclase, putative	0.0013	0.0076	0.0026
Trypanosoma cruzi	PAS-domain containing phosphoglycerate kinase, putative	0.0013	0.0076	0.0609
Schistosoma mansoni	hypothetical protein	0.0032	0.066	0.0538
Trypanosoma cruzi	STE group serine/threonine-protein kinase, putative	0.0013	0.0076	0.0609

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (functional)	= 9 uM	Cytotoxicity against c-DDP-resistant human A2780 cells after 72 hrs by crystal violet dye assay	ChEMBL.	22029378
IC50 (functional)	= 10 uM	Cytotoxicity against human A2780 cells after 72 hrs by crystal violet dye assay	ChEMBL.	22029378
IC50 (functional)	= 13 uM	Cytotoxicity against human HCT116 cells after 48 hrs by crystal violet dye assay	ChEMBL.	22029378
IC50 (functional)	= 17 uM	Cytotoxicity against human HCT116 cells after 24 hrs by crystal violet dye assay	ChEMBL.	22029378
IC50 (functional)	= 24 uM	Cytotoxicity against c-DDP-resistant human A2780 cells after 48 hrs by crystal violet dye assay	ChEMBL.	22029378
IC50 (functional)	= 26 uM	Cytotoxicity against human LoVo cells after 48 hrs by crystal violet dye assay	ChEMBL.	22029378
IC50 (functional)	= 27 uM	Cytotoxicity against human LoVo cells after 24 hrs by crystal violet dye assay	ChEMBL.	22029378
IC50 (functional)	= 36 uM	Cytotoxicity against human A2780 cells after 48 hrs by crystal violet dye assay	ChEMBL.	22029378
IC50 (functional)	= 40 uM	Cytotoxicity against human A2780 cells after 24 hrs by crystal violet dye assay	ChEMBL.	22029378
IC50 (functional)	> 100 uM	Cytotoxicity against c-DDP-resistant human A2780 cells after 24 hrs by crystal violet dye assay	ChEMBL.	22029378

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Homo sapiens	ChEMBL23	22029378

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

ChEMBL: CHEMBL1922721

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1564929