TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 421.554 | Formula: C21H31N3O4S
H donors: 1 H acceptors: 3 LogP: 3.44 Rotable bonds: 9
Rule of 5 violations (Lipinski): 1
SMILES: CCOC(=O)c1c(NC(=O)N(C2CCCCC2)CC)sc2c1CCN(C2)C(=O)C
InChi: 1S/C21H31N3O4S/c1-4-24(15-9-7-6-8-10-15)21(27)22-19-18(20(26)28-5-2)16-11-12-23(14(3)25)13-17(16)29-19/h15H,4-13H2,1-3H3,(H,22,27)
InChiKey: UCLOPXWAPMIVNZ-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

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
Trichomonas vaginalis	sugar transporter, putative	0.0034	0.0593	0.2252
Trypanosoma cruzi	hexose transporter, putative	0.0034	0.0593	0.2217
Trichomonas vaginalis	sugar transport protein, putative	0.0015	0.0188	0.0348
Echinococcus multilocularis	synaptic vesicle 2 protein	0.0015	0.0188	0.0111
Brugia malayi	ImpB/MucB/SamB family protein	0.0015	0.0177	0.0124
Echinococcus granulosus	acetylcholinesterase	0.0071	0.1402	0.1933
Trichomonas vaginalis	geranylgeranyl pyrophosphate synthase, putative	0.01	0.2052	0.9104
Mycobacterium tuberculosis	Probable geranylgeranyl pyrophosphate synthetase IdsA2 (ggppsase) (GGPP synthetase) (geranylgeranyl diphosphate synthase)	0.01	0.2052	1
Trichomonas vaginalis	conserved hypothetical protein	0.0034	0.0593	0.2252
Trypanosoma brucei	GTP-binding nuclear protein rtb2, putative	0.0022	0.0329	0.1522
Echinococcus granulosus	solute carrier family 22	0.0015	0.0188	0.0111
Schistosoma mansoni	lamin	0.0028	0.0459	0.0518
Schistosoma mansoni	glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs)	0.0033	0.0569	0.0683
Brugia malayi	major facilitator superfamily protein	0.0015	0.0188	0.0144
Entamoeba histolytica	protein kinase, putative	0.0033	0.0584	0.7622
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0188	0.0348
Brugia malayi	ubiquitin conjugating enzyme protein 13	0.0039	0.071	0.1157
Leishmania major	myo-inositol/proton symporter (MIT)	0.0015	0.0188	0.0055
Mycobacterium ulcerans	lysyl-tRNA synthetase	0.0024	0.0385	0.144
Plasmodium vivax	hexose transporter	0.0109	0.2243	0.2094
Plasmodium vivax	lysine--tRNA ligase, putative	0.0024	0.0385	0.0201
Echinococcus granulosus	prenyl decaprenyl diphosphate synthase	0.0025	0.0407	0.044
Trichomonas vaginalis	conserved hypothetical protein	0.0034	0.0593	0.2252
Leishmania major	protein kinase, putative	0.0033	0.0584	0.2167
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0042	0.0776	0.3194
Onchocerca volvulus		0.0015	0.0188	0.0144
Echinococcus granulosus	snurportin 1	0.0316	0.6783	1
Onchocerca volvulus		0.0015	0.0188	0.0144
Echinococcus multilocularis	musashi	0.0028	0.0459	0.0518
Echinococcus multilocularis	farnesyl pyrophosphate synthase	0.01	0.2052	0.2907
Trichomonas vaginalis	DNA polymerase eta, putative	0.0042	0.0776	0.3112
Schistosoma mansoni	farnesyl pyrophosphate synthase	0.01	0.2052	0.2907
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0109	0.2243	0.3192
Brugia malayi	lysyl-tRNA synthetase	0.0024	0.0385	0.0527
Onchocerca volvulus		0.0015	0.0188	0.0144
Schistosoma mansoni	glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs)	0.0033	0.0569	0.0683
Toxoplasma gondii	sugar transporter ST2	0.0015	0.0188	0.0133
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0188	0.0111
Trypanosoma cruzi	importin beta-1 subunit, putative	0.0024	0.0378	0.107
Schistosoma mansoni	sugar transporter	0.0015	0.0188	0.0111
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0385	0.0407
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0012	0.0114	0.0553
Trypanosoma brucei	DNA polymerase kappa, putative	0.0042	0.0776	0.3721
Schistosoma mansoni	lamin	0.0028	0.0459	0.0518
Giardia lamblia	Farnesyl diphosphate synthase	0.01	0.2052	1
Trichomonas vaginalis	conserved hypothetical protein	0.0015	0.0188	0.0348
Loa Loa (eye worm)	major facilitator superfamily transporter	0.0015	0.0188	0.0111
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0033	0.0584	0.0705
Schistosoma mansoni	glutathione synthetase	0.0025	0.0407	0.044
Echinococcus granulosus	dna polymerase eta	0.0015	0.0177	0.0096
Trypanosoma brucei	glucose transporter, putative	0.0034	0.0593	0.282
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0042	0.0776	0.3194
Schistosoma mansoni	sugar transporter	0.0015	0.0188	0.0111
Toxoplasma gondii	sugar transporter ST1	0.0015	0.0188	0.0133
Schistosoma mansoni	hypothetical protein	0.0316	0.6783	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0017	0.0225	0.1008
Mycobacterium ulcerans	fusion protein of transposase for IS2606 and sialic acid-transport integral membrane protein NanT	0.0015	0.0188	0.0425
Trichomonas vaginalis	lysyl-tRNA synthetase, putative	0.0024	0.0385	0.1276
Plasmodium falciparum	calcium-dependent protein kinase 1	0.0033	0.0584	0.0404
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0188	0.0348
Schistosoma mansoni	terminal deoxycytidyl transferase	0.0015	0.0177	0.0096
Loa Loa (eye worm)	hypothetical protein	0.0013	0.0133	0.003
Trypanosoma brucei	DNA polymerase kappa, putative	0.0042	0.0776	0.3721
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0584	0.0705
Loa Loa (eye worm)	hypothetical protein	0.0013	0.0133	0.003
Leishmania major	glucose transporter, lmgt3	0.0034	0.0593	0.2217
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0188	0.0348
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0188	0.0348
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0034	0.0593	0.282
Toxoplasma gondii	HEAT repeat-containing protein	0.003	0.0501	0.0614
Schistosoma mansoni	ran	0.0022	0.0329	0.0324
Echinococcus multilocularis	solute carrier family 22	0.0015	0.0188	0.0111
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0109	0.2243	0.3192
Plasmodium vivax	importin-beta 2, putative	0.003	0.0501	0.0319
Brugia malayi	Sugar transporter family protein	0.0015	0.0188	0.0144
Trypanosoma brucei	glucose transporter 1E	0.0034	0.0593	0.282
Leishmania major	hypothetical protein, conserved	0.0015	0.0188	0.0055
Echinococcus granulosus	solute carrier family 22	0.0015	0.0188	0.0111
Onchocerca volvulus		0.0028	0.0459	0.0669
Onchocerca volvulus		0.0015	0.0188	0.0144
Trypanosoma brucei	DNA polymerase kappa, putative	0.0022	0.0326	0.1506
Brugia malayi	Ubiquitin conjugating enzyme protein 13	0.0039	0.071	0.1157
Loa Loa (eye worm)	nucleolar RNA-associated protein alpha	0.0316	0.6783	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0042	0.0776	0.3721
Schistosoma mansoni	glucose transport protein	0.0109	0.2243	0.3192
Leishmania major	DNA polymerase kappa, putative,DNA polymerase IV, putative	0.0022	0.0326	0.0792
Plasmodium vivax	calcium-dependent protein kinase 4, putative	0.0033	0.0584	0.0404
Plasmodium falciparum	lysine--tRNA ligase	0.0024	0.0385	0.0201
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0109	0.2243	0.3192
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0033	0.0584	0.0705
Trichomonas vaginalis	prolyl-tRNA synthetase, putative	0.0033	0.0569	0.2139
Mycobacterium ulcerans	sugar transporter	0.0015	0.0188	0.0425
Plasmodium vivax	calcium-dependent protein kinase, putative	0.0033	0.0584	0.0404
Loa Loa (eye worm)	pax transcription factor protein 2	0.0247	0.5271	0.7733
Mycobacterium leprae	Possible lysyl-tRNA synthetase 2 LysX	0.0024	0.0385	0.3046
Trypanosoma brucei	DNA polymerase kappa, putative	0.0032	0.0551	0.2615
Plasmodium falciparum	calcium-dependent protein kinase 4	0.0033	0.0584	0.0404
Echinococcus multilocularis	carboxylesterase 5A	0.0071	0.1402	0.1933
Schistosoma mansoni	protein kinase	0.0033	0.0584	0.0705
Brugia malayi	hypothetical protein	0.0015	0.0188	0.0144
Trypanosoma cruzi	farnesyl pyrophosphate synthase	0.01	0.2052	1
Leishmania major	GTP-binding protein, putative	0.0022	0.0329	0.0811
Plasmodium falciparum	calcium-dependent protein kinase 3	0.0033	0.0584	0.0404
Mycobacterium ulcerans	geranylgeranyl pyrophosphate synthase	0.01	0.2052	1
Echinococcus multilocularis	dna polymerase eta	0.0015	0.0177	0.0096
Trypanosoma cruzi	hexose transporter, putative	0.0015	0.0188	0.0055
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0188	0.0111
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0188	0.0348
Trypanosoma brucei	glucose transporter 2A	0.0034	0.0593	0.282
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0188	0.0111
Entamoeba histolytica	geranylgeranyl pyrophosphate synthase, putative	0.0025	0.0407	0.4303
Brugia malayi	cytoplasmic intermediate filament protein	0.0015	0.0177	0.0123
Echinococcus multilocularis	calcium dependent protein kinase	0.0031	0.0538	0.0637
Trypanosoma cruzi	prolyl-tRNA synthetase, putative	0.0038	0.0688	0.2722
Brugia malayi	Major Facilitator Superfamily protein	0.0015	0.0188	0.0144
Trypanosoma cruzi	prolyl-tRNA synthetase, putative	0.0038	0.0688	0.2722
Mycobacterium ulcerans	DNA polymerase IV	0.0042	0.0776	0.3448
Giardia lamblia	DINP protein human, muc B family	0.0022	0.0326	0.0742
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0188	0.0348
Brugia malayi	polk-prov protein	0.0032	0.0551	0.0849
Brugia malayi	Cam kinase protein 1	0.0033	0.0584	0.0912
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0012	0.0114	0.0553
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0448	0.0501
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0188	0.0348
Brugia malayi	Carboxylesterase family protein	0.0071	0.1402	0.2499
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0034	0.0593	0.282
Loa Loa (eye worm)	ImpB/MucB/SamB family protein	0.0015	0.0177	0.0096
Echinococcus granulosus	synaptic vesicle 2 protein	0.0015	0.0188	0.0111
Plasmodium vivax	ubiquitin-conjugating enzyme E2 N, putative	0.0039	0.071	0.0533
Echinococcus granulosus	lamin	0.0028	0.0459	0.0518
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0188	0.0348
Trypanosoma cruzi	GTP-binding nuclear protein rtb2, putative	0.0022	0.0329	0.0811
Mycobacterium leprae	Probable prolyl tRNA synthetase ProS	0.0033	0.0569	1
Trichomonas vaginalis	DNA polymerase IV / kappa, putative	0.0042	0.0776	0.3112
Echinococcus multilocularis	dna polymerase kappa	0.0042	0.0776	0.0994
Plasmodium falciparum	proline--tRNA ligase	0.0038	0.0688	0.051
Trypanosoma brucei	DNA polymerase kappa, putative	0.0032	0.0551	0.2615
Toxoplasma gondii	ubiquitin-conjugating enzyme subfamily protein	0.0039	0.071	0.0936
Onchocerca volvulus		0.0015	0.0188	0.0144
Chlamydia trachomatis	lysine--tRNA ligase	0.0024	0.0385	0.9286
Loa Loa (eye worm)	sugar transporter	0.0109	0.2243	0.3192
Echinococcus granulosus	intermediate filament protein	0.0028	0.0459	0.0518
Mycobacterium ulcerans	lysyl-tRNA synthetase	0.0024	0.0385	0.144
Trypanosoma cruzi	polyprenyl synthase, putative	0.0025	0.0407	0.1223
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0188	0.0111
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0042	0.0776	0.3194
Echinococcus multilocularis	glutamyl tRNA synthetase cytoplasmic	0.0033	0.0569	0.0683
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0033	0.0584	0.0705
Leishmania major	glucose transporter, lmgt2	0.0034	0.0593	0.2217
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0109	0.2243	0.3192
Schistosoma mansoni	nuclear transcription factor X-box binding 1 (nfx1)	0.0015	0.0188	0.0111
Echinococcus granulosus	solute carrier family 22	0.0015	0.0188	0.0111
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0188	0.0348
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0188	0.0111
Echinococcus granulosus	importin subunit beta 1	0.003	0.0501	0.0581
Entamoeba histolytica	prolyl-tRNA synthetase, putative	0.0033	0.0569	0.7344
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type 1	0.0033	0.0584	0.0705
Trypanosoma brucei	DNA polymerase kappa, putative	0.0017	0.0225	0.1008
Schistosoma mansoni	sugar transporter	0.0015	0.0188	0.0111
Trypanosoma brucei	myo-inositol/proton symporter (MIT)	0.0015	0.0188	0.0825
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0015	0.0177	0.0864
Echinococcus multilocularis	lamin dm0	0.0028	0.0459	0.0518
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0188	0.0348
Trypanosoma cruzi	solanesyl-diphosphate synthase	0.0025	0.0407	0.1223
Trypanosoma brucei	glucose transporter, putative	0.0034	0.0593	0.282
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0188	0.0111
Trypanosoma brucei	unspecified product	0.001	0.0076	0.0277
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0434	0.0481
Plasmodium falciparum	protein kinase 7	0.0308	0.6607	0.6542
Trypanosoma brucei	DNA polymerase eta, putative	0.0015	0.0177	0.0775
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0188	0.0111
Trypanosoma cruzi	solanesyl-diphosphate synthase, putative	0.0025	0.0407	0.1223
Loa Loa (eye worm)	hypothetical protein	0.0071	0.1402	0.1933
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0188	0.0348
Brugia malayi	major facilitator superfamily protein	0.0015	0.0188	0.0144
Trypanosoma brucei	DNA polymerase kappa, putative	0.0042	0.0776	0.3721
Brugia malayi	Major Facilitator Superfamily protein	0.0015	0.0188	0.0144
Leishmania major	importin beta-1 subunit, putative	0.0024	0.0378	0.107
Entamoeba histolytica	ubiquitin-conjugating enzyme family protein	0.0039	0.071	1
Plasmodium vivax	GTP-binding nuclear protein RAN/TC4, putative	0.0022	0.0329	0.0144
Trypanosoma brucei	DNA polymerase IV, putative	0.0042	0.0776	0.3721
Trichomonas vaginalis	ran, putative	0.0022	0.0329	0.1014
Plasmodium falciparum	calcium-dependent protein kinase 2	0.0033	0.0584	0.0404
Chlamydia trachomatis	geranylgeranyl pyrophosphate synthase	0.0025	0.0407	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0017	0.0225	0.1008
Schistosoma mansoni	hypothetical protein	0.0174	0.3667	0.5328
Toxoplasma gondii	calcium-dependent protein kinase CDPK3	0.0033	0.0584	0.0742
Toxoplasma gondii	sugar transporter ST3	0.0015	0.0188	0.0133
Plasmodium vivax	CDK-related protein kinase 6, putative	0.0462	1	1
Brugia malayi	Calcium/calmodulin-dependent protein kinase type II alpha chain	0.0033	0.0584	0.0912
Brugia malayi	intermediate filament protein	0.0028	0.0459	0.0669
Schistosoma mansoni	hypothetical protein	0.0109	0.2243	0.3192
Loa Loa (eye worm)	hypothetical protein	0.003	0.0501	0.0581
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0188	0.0348
Plasmodium falciparum	mitogen-activated protein kinase 2	0.0176	0.3715	0.3595
Loa Loa (eye worm)	polyprenyl synthetase	0.0025	0.0407	0.044
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0188	0.0348
Echinococcus multilocularis	geranylgeranyl pyrophosphate synthase	0.0025	0.0407	0.044
Loa Loa (eye worm)	GTP-binding nuclear protein RAN/TC4	0.0022	0.0329	0.0324
Brugia malayi	RNA, U transporter 1	0.0084	0.1698	0.3072
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0109	0.2243	0.3192
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0188	0.0348
Schistosoma mansoni	importin beta-1	0.003	0.0501	0.0581
Trichomonas vaginalis	Importin beta-1 subunit, putative	0.0024	0.0378	0.1242
Loa Loa (eye worm)	geranylgeranyl pyrophosphate synthetase	0.0025	0.0407	0.044
Echinococcus granulosus	lamin dm0	0.0028	0.0459	0.0518
Echinococcus multilocularis	prenyl (decaprenyl) diphosphate synthase	0.0025	0.0407	0.044
Trypanosoma brucei	sugar transporter, putative	0.0015	0.0188	0.0825
Mycobacterium tuberculosis	Probable dicarboxylic acid transport integral membrane protein KgtP (dicarboxylate transporter)	0.0015	0.0188	0.0915
Schistosoma mansoni	geranylgeranyl pyrophosphate synthase	0.0025	0.0407	0.044
Toxoplasma gondii	cell-cycle-associated protein kinase MAPK, putative	0.0176	0.3715	0.5555
Mycobacterium ulcerans	integral membrane transport protein	0.0015	0.0188	0.0425
Echinococcus multilocularis	solute carrier family 22	0.0015	0.0188	0.0111
Trypanosoma cruzi	ubiquitin-conjugating enzyme E2, putative	0.0039	0.071	0.2844
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0188	0.0111
Trypanosoma brucei	glucose transporter, putative	0.0034	0.0593	0.282
Trichomonas vaginalis	conserved hypothetical protein	0.0015	0.0188	0.0348
Schistosoma mansoni	glucose transport protein	0.0109	0.2243	0.3192
Loa Loa (eye worm)	carboxylesterase	0.0071	0.1402	0.1933
Leishmania major	ubiquitin-conjugating enzyme e2, putative	0.0039	0.071	0.2844
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0042	0.0776	0.3194
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0188	0.0348
Toxoplasma gondii	prolyl-tRNA synthetase (ProRS)	0.0038	0.0688	0.0902
Mycobacterium tuberculosis	Lysyl-tRNA synthetase 2 LysX	0.0021	0.0305	0.1485
Schistosoma mansoni	glucose transporter	0.0015	0.0188	0.0111
Trypanosoma cruzi	glucose transporter, putative	0.0015	0.0188	0.0055
Loa Loa (eye worm)	ubiquitin conjugating enzyme protein 13	0.0039	0.071	0.0895
Schistosoma mansoni	ubiquitin conjugating enzyme 13	0.0039	0.071	0.0895
Echinococcus multilocularis	ubiquitin conjugating enzyme E2 N	0.0039	0.071	0.0895
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0188	0.0348
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0109	0.2243	0.3192
Onchocerca volvulus	Putative transporter	0.0015	0.0188	0.0144
Brugia malayi	Carboxylesterase family protein	0.0071	0.1402	0.2499
Brugia malayi	hypothetical protein	0.0015	0.0188	0.0144
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0188	0.0111
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0188	0.0348
Trypanosoma brucei	DNA polymerase kappa, putative	0.0042	0.0776	0.3721
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0188	0.0348
Echinococcus granulosus	dna polymerase kappa	0.0042	0.0776	0.0994
Plasmodium falciparum	hexose transporter	0.0109	0.2243	0.2094
Onchocerca volvulus		0.0015	0.0188	0.0144
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0028	0.0459	0.0518
Trypanosoma brucei	lysyl-tRNA synthetase, putative	0.0024	0.0385	0.1797
Toxoplasma gondii	calcium-dependent protein kinase CDPK2A	0.0033	0.0584	0.0742
Entamoeba histolytica	geranylgeranyl pyrophosphate synthetase, putative	0.0025	0.0407	0.4303
Trichomonas vaginalis	glucose transporter, putative	0.0034	0.0593	0.2252
Onchocerca volvulus		0.0015	0.0188	0.0144
Schistosoma mansoni	rab geranylgeranyl transferase alpha subunit	0.0015	0.0177	0.0096
Trypanosoma brucei	glucose transporter, putative	0.0034	0.0593	0.282
Trypanosoma brucei	bifunctional aminoacyl-tRNA synthetase, putative	0.0038	0.0688	0.3286
Leishmania major	solanesyl-diphosphate synthase, putative	0.0025	0.0407	0.1223
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0188	0.0348
Trypanosoma brucei	calcium/calmodulin-dependent protein kinase, putative	0.0033	0.0584	0.2774
Onchocerca volvulus		0.0015	0.0188	0.0144
Onchocerca volvulus		0.0015	0.0188	0.0144
Schistosoma mansoni	DNA polymerase eta	0.0015	0.0177	0.0096
Trichomonas vaginalis	Importin beta-1 subunit, putative	0.0024	0.0378	0.1242
Leishmania major	DNA polymerase kappa, putative	0.0022	0.0326	0.0792
Brugia malayi	Sugar transporter family protein	0.0109	0.2243	0.4128
Echinococcus granulosus	lysyl tRNA synthetase	0.0024	0.0385	0.0407
Entamoeba histolytica	Ran family GTPase	0.0022	0.0329	0.285
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0109	0.2243	0.3192
Brugia malayi	Major Facilitator Superfamily protein	0.0015	0.0188	0.0144
Trypanosoma brucei	unspecified product	0.0035	0.0628	0.299
Trypanosoma brucei	farnesyl pyrophosphate synthase	0.01	0.2052	1
Entamoeba histolytica	protein kinase, putative	0.0033	0.0584	0.7622
Mycobacterium ulcerans	sugar-transport integral membrane protein SugI	0.0015	0.0188	0.0425
Onchocerca volvulus		0.0015	0.0188	0.0144
Plasmodium falciparum	ubiquitin-conjugating enzyme E2 N, putative	0.0039	0.071	0.0533
Onchocerca volvulus		0.0015	0.0188	0.0144
Brugia malayi	Polyprenyl synthetase family protein	0.01	0.2052	0.3759
Toxoplasma gondii	protein kinase, putative	0.0308	0.6607	1
Trypanosoma cruzi	polyprenyl synthase, putative	0.0025	0.0407	0.1223
Brugia malayi	bifunctional aminoacyl-tRNA synthetase	0.0033	0.0569	0.0883
Brugia malayi	Polyprenyl synthetase family protein	0.0025	0.0407	0.0569
Trichomonas vaginalis	myo-inositol transporter, putative	0.0015	0.0188	0.0348
Echinococcus multilocularis	lysyl tRNA synthetase	0.0024	0.0385	0.0407
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0188	0.0348
Loa Loa (eye worm)	calcium/calmodulin-dependent protein kinase ID	0.0033	0.0584	0.0705
Schistosoma mansoni	intermediate filament proteins	0.0028	0.0459	0.0518
Echinococcus multilocularis	GTP binding nuclear protein Ran	0.0022	0.0329	0.0324
Trypanosoma brucei	DNA polymerase kappa, putative	0.0042	0.0776	0.3721
Leishmania major	glucose transporter, lmgt1	0.0034	0.0593	0.2217
Mycobacterium tuberculosis	Probable multifunctional geranylgeranyl pyrophosphate synthetase IdsA1 (GGPP synthetase) (ggppsase) (geranylgeranyl diphosphate	0.0025	0.0407	0.1982
Leishmania major	polyprenyl synthase, putative	0.0025	0.0407	0.1223
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0033	0.0584	0.0705
Schistosoma mansoni	hypothetical protein	0.0174	0.3667	0.5328
Trypanosoma brucei	DNA polymerase IV, putative	0.0042	0.0776	0.3721
Loa Loa (eye worm)	hypothetical protein	0.0071	0.1402	0.1933
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0188	0.0348
Onchocerca volvulus		0.0015	0.0188	0.0144
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0188	0.0348
Echinococcus granulosus	Sugar transporter ERD6 protein	0.0015	0.0188	0.0111
Trypanosoma cruzi	ubiquitin-conjugating enzyme E2, putative	0.0039	0.071	0.2844
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0071	0.1402	0.1933
Echinococcus multilocularis	solute carrier family 22	0.0015	0.0188	0.0111
Loa Loa (eye worm)	CAMK/CAMK2 protein kinase	0.0033	0.0584	0.0705
Trichomonas vaginalis	conserved hypothetical protein	0.0015	0.0188	0.0348
Toxoplasma gondii	polyprenyl synthetase superfamily protein	0.0025	0.0407	0.047
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0188	0.0348
Trypanosoma brucei	glucose transporter, putative	0.0034	0.0593	0.282
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0188	0.0348
Echinococcus multilocularis	geminin	0.0174	0.3667	0.5328
Plasmodium falciparum	calcium-dependent protein kinase 5	0.0033	0.0584	0.0404
Mycobacterium tuberculosis	Possible polyprenyl synthetase IdsB (polyprenyl transferase) (polyprenyl diphosphate synthase)	0.0025	0.0407	0.1982
Echinococcus granulosus	acetylcholinesterase	0.0071	0.1402	0.1933
Trichomonas vaginalis	glucose transporter, putative	0.0034	0.0593	0.2252
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0188	0.0348
Schistosoma mansoni	sugar transporter	0.0015	0.0188	0.0111
Brugia malayi	Bifunctional aminoacyl-tRNA synthetase	0.0033	0.0569	0.0883
Onchocerca volvulus		0.0015	0.0188	0.0144
Toxoplasma gondii	lysine-tRNA ligase	0.0024	0.0385	0.0437
Trypanosoma cruzi	lysyl-tRNA synthetase, putative	0.0024	0.0385	0.1109
Treponema pallidum	octaprenyl-diphosphate synthase	0.0025	0.0407	1
Mycobacterium tuberculosis	Probable conserved integral membrane transport protein	0.0015	0.0188	0.0915
Schistosoma mansoni	glucose transport protein	0.0109	0.2243	0.3192
Trypanosoma cruzi	hexose transporter, putative	0.0034	0.0593	0.2217
Echinococcus multilocularis	cytoplasmic intermediate filament protein	0.0013	0.0144	0.0046
Brugia malayi	geranylgeranyl pyrophosphate synthetase	0.0025	0.0407	0.0569
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0188	0.0348
Plasmodium vivax	mitogen-activated protein kinase 2, putative	0.0176	0.3715	0.3595
Plasmodium vivax	proline--tRNA ligase, putative	0.0038	0.0688	0.051
Trypanosoma cruzi	sugar transporter, putative	0.0015	0.0188	0.0055
Echinococcus granulosus	carboxylesterase 5A	0.0071	0.1402	0.1933
Plasmodium falciparum	importin beta, putative	0.003	0.0501	0.0319
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0188	0.0111
Trypanosoma brucei	importin beta-1 subunit, putative	0.003	0.0501	0.2366
Echinococcus granulosus	cytoplasmic intermediate filament protein	0.0013	0.0144	0.0046
Trichomonas vaginalis	geranylgeranyl pyrophosphate synthase, putative	0.01	0.2052	0.9104
Toxoplasma gondii	transporter, major facilitator family protein	0.0015	0.0188	0.0133
Echinococcus multilocularis	General substrate transporter	0.0094	0.1906	0.2688
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0188	0.0111
Loa Loa (eye worm)	hypothetical protein	0.0013	0.0144	0.0046
Leishmania major	farnesyl pyrophosphate synthase	0.01	0.2052	1
Brugia malayi	Pax transcription factor protein 2	0.0247	0.5271	1
Echinococcus multilocularis	snurportin 1	0.0316	0.6783	1
Onchocerca volvulus		0.0015	0.0188	0.0144
Wolbachia endosymbiont of Brugia malayi	geranylgeranyl pyrophosphate synthase	0.0025	0.0407	1
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0177	0.0096
Loa Loa (eye worm)	polyprenyl synthetase	0.01	0.2052	0.2907
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0551	0.0657
Wolbachia endosymbiont of Brugia malayi	geranylgeranyl pyrophosphate synthase	0.0025	0.0407	1
Mycobacterium tuberculosis	Carboxylesterase LipT	0.0012	0.0114	0.0553
Mycobacterium tuberculosis	Lysyl-tRNA synthetase 1 LysS (lysine--tRNA ligase 1) (LysRS 1) (lysine translase)	0.0021	0.0305	0.1485
Onchocerca volvulus		0.0247	0.5271	1
Toxoplasma gondii	facilitative glucose transporter GT1	0.0109	0.2243	0.3291
Echinococcus multilocularis	acetylcholinesterase	0.0071	0.1402	0.1933
Plasmodium vivax	geranylgeranyl pyrophosphate synthase	0.01	0.2052	0.19
Plasmodium falciparum	GTP-binding nuclear protein RAN/TC4	0.0022	0.0329	0.0144
Echinococcus granulosus	calcium dependent protein kinase	0.0031	0.0538	0.0637
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0188	0.0348
Brugia malayi	Intermediate filament tail domain containing protein	0.0028	0.0459	0.0669
Schistosoma mansoni	lysyl-tRNA synthetase	0.0024	0.0385	0.0407
Loa Loa (eye worm)	cytoplasmic intermediate filament protein	0.0015	0.0177	0.0095
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0188	0.0348
Trichomonas vaginalis	ubiquitin-conjugating enzyme E2, putative	0.0039	0.071	0.2804
Echinococcus granulosus	glutamyl tRNA synthetase cytoplasmic	0.0033	0.0569	0.0683
Echinococcus multilocularis	Sugar transporter ERD6 protein	0.0015	0.0188	0.0111
Onchocerca volvulus		0.0015	0.0188	0.0144
Loa Loa (eye worm)	acetylcholinesterase 1	0.0071	0.1402	0.1933
Trichomonas vaginalis	conserved hypothetical protein	0.0015	0.0188	0.0348
Echinococcus granulosus	geranylgeranyl pyrophosphate synthase	0.0025	0.0407	0.044
Schistosoma mansoni	serine/threonine protein kinase	0.0033	0.0584	0.0705
Echinococcus granulosus	farnesyl pyrophosphate synthase	0.01	0.2052	0.2907
Echinococcus granulosus	decaprenyl diphosphate synthase subunit 1	0.0025	0.0407	0.044
Mycobacterium ulcerans	DNA polymerase IV	0.0042	0.0776	0.3448
Trypanosoma brucei	DNA polymerase kappa, putative	0.0042	0.0776	0.3721
Echinococcus granulosus	geminin	0.0174	0.3667	0.5328
Giardia lamblia	Prolyl-tRNA synthetase	0.0033	0.0569	0.2045
Trypanosoma brucei	solanesyl-diphosphate synthase, putative	0.0025	0.0407	0.1903
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0188	0.0348
Giardia lamblia	GTP-binding nuclear protein RAN/TC4	0.0022	0.0329	0.076
Brugia malayi	GTP-binding nuclear protein RAN/TC4	0.0022	0.0329	0.0418
Loa Loa (eye worm)	ubiquitin conjugating enzyme protein 13	0.0039	0.071	0.0895
Echinococcus multilocularis	importin subunit beta 1	0.003	0.0501	0.0581
Schistosoma mansoni	protein kinase	0.0033	0.0584	0.0705
Plasmodium falciparum	octaprenyl pyrophosphate synthase	0.0025	0.0407	0.0223
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0569	0.0683
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0188	0.0348
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0033	0.0584	0.0705
Echinococcus granulosus	solute carrier family 22	0.0015	0.0188	0.0111
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0188	0.0348
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0033	0.0584	0.0705
Echinococcus granulosus	ubiquitin conjugating enzyme E2 N	0.0039	0.071	0.0895
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0188	0.0348
Loa Loa (eye worm)	major facilitator superfamily transporter	0.0015	0.0188	0.0111
Trypanosoma brucei	ubiquitin-protein ligase, putative	0.0039	0.071	0.3398
Mycobacterium tuberculosis	Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed))	0.0022	0.0326	0.1588
Leishmania major	prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative	0.0038	0.0688	0.2722
Leishmania major	glucose transporter/membrane transporter D2, putative	0.0034	0.0593	0.2217
Trichomonas vaginalis	glucose transporter, putative	0.0015	0.0188	0.0348
Toxoplasma gondii	GTP-binding nuclear protein ran/tc4	0.0022	0.0329	0.0351
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0188	0.0111
Trypanosoma cruzi	hexose transporter, putative	0.0034	0.0593	0.2217
Trypanosoma cruzi	hexose transporter, putative	0.0018	0.0257	0.0424
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0459	0.0518
Trichomonas vaginalis	ubiquitin-conjugating enzyme E2, putative	0.0039	0.071	0.2804
Mycobacterium leprae	PROBABLE POLYPRENYL-DIPHOSPHATE SYNTHASE GRCC1 (POLYPRENYL PYROPHOSPHATE SYNTHETASE)	0.0025	0.0407	0.3862
Echinococcus multilocularis	terminal deoxycytidyl transferase rev1	0.0015	0.0177	0.0096
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0188	0.0111
Trichomonas vaginalis	conserved hypothetical protein	0.0015	0.0188	0.0348
Echinococcus granulosus	terminal deoxycytidyl transferase rev1	0.0015	0.0177	0.0096
Trypanosoma brucei	glucose transporter, putative	0.0034	0.0593	0.282
Trypanosoma cruzi	hexose transporter	0.0034	0.0593	0.2217
Onchocerca volvulus		0.0015	0.0188	0.0144
Leishmania major	lysyl-tRNA synthetase, putative	0.0024	0.0385	0.1109
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0033	0.0584	0.0705
Trypanosoma brucei	glucose transporter, putative	0.0034	0.0593	0.282
Mycobacterium ulcerans	polyprenyl diphosphate synthetase, GrcC1	0.0025	0.0407	0.155
Plasmodium vivax	octaprenyl pyrophosphate synthase, putative	0.0025	0.0407	0.0223
Toxoplasma gondii	polyprenyl synthetase superfamily protein	0.01	0.2052	0.2998
Mycobacterium ulcerans	polyprenyl synthetase IdsB	0.0025	0.0407	0.155
Entamoeba histolytica	bifunctional short chain isoprenyl diphosphate synthase, putative	0.0025	0.0407	0.4303
Echinococcus granulosus	General substrate transporter	0.0094	0.1906	0.2688
Toxoplasma gondii	calcium-dependent protein kinase CDPK2B	0.0033	0.0584	0.0742
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0188	0.0348
Trichomonas vaginalis	importin beta-1, putative	0.0024	0.0378	0.1242
Loa Loa (eye worm)	intermediate filament protein	0.0028	0.0459	0.0518
Schistosoma mansoni	ran	0.0022	0.0329	0.0324
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0188	0.0348
Entamoeba histolytica	hypothetical protein	0.0024	0.0378	0.3763
Mycobacterium ulcerans	carboxylesterase, LipT	0.0012	0.0114	0.0045
Echinococcus multilocularis	solute carrier family 2, facilitated glucose	0.0109	0.2243	0.3192
Echinococcus multilocularis	solute carrier family 22	0.0015	0.0188	0.0111
Trichomonas vaginalis	geranylgeranyl diphosphate synthase, putative	0.01	0.2052	0.9104
Plasmodium falciparum	geranylgeranyl pyrophosphate synthase, putative	0.01	0.2052	0.19
Echinococcus granulosus	GTP binding nuclear protein Ran	0.0022	0.0329	0.0324
Leishmania major	prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative	0.0038	0.0688	0.2722
Trypanosoma cruzi	farnesyl pyrophosphate synthase, putative	0.01	0.2052	1
Plasmodium vivax	calcium-dependent protein kinase 3, putative	0.0033	0.0584	0.0404
Loa Loa (eye worm)	bifunctional aminoacyl-tRNA synthetase	0.0013	0.0146	0.0049
Onchocerca volvulus		0.0028	0.0459	0.0669
Mycobacterium tuberculosis	Probable polyprenyl-diphosphate synthase GrcC2 (polyprenyl pyrophosphate synthetase)	0.0025	0.0407	0.1982
Trypanosoma brucei	DNA polymerase kappa, putative	0.0042	0.0776	0.3721
Trichomonas vaginalis	sugar transporter, putative	0.0034	0.0593	0.2252
Schistosoma mansoni	protein kinase	0.0033	0.0584	0.0705
Trypanosoma cruzi	solanesyl-diphosphate synthase, putative	0.0025	0.0407	0.1223
Trichomonas vaginalis	CAMK family protein kinase	0.0033	0.0584	0.2208
Loa Loa (eye worm)	sugar transporter	0.0015	0.0188	0.0111
Trypanosoma brucei	unspecified product	0.001	0.0076	0.0277
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0569	0.0683
Trypanosoma brucei	DNA polymerase IV, putative	0.0035	0.0628	0.299
Trypanosoma brucei	DNA polymerase kappa, putative	0.0042	0.0776	0.3721
Brugia malayi	Importin beta-1 subunit	0.003	0.0501	0.0751
Echinococcus multilocularis	acetylcholinesterase	0.0071	0.1402	0.1933
Trypanosoma brucei	importin beta-1 subunit, putative	0.003	0.0501	0.2366
Plasmodium vivax	calcium-dependent protein kinase 1, putative	0.0033	0.0584	0.0404
Mycobacterium ulcerans	geranylgeranyl pyrophosphate synthase	0.01	0.2052	1
Trypanosoma brucei	glucose transporter, putative	0.0034	0.0593	0.282
Schistosoma mansoni	trans-prenyltransferase	0.0025	0.0407	0.044
Brugia malayi	ImpB/MucB/SamB family protein	0.0015	0.0177	0.0124
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0188	0.0111
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0188	0.0348
Giardia lamblia	Lysyl-tRNA synthetase	0.0024	0.0385	0.1059
Echinococcus multilocularis	decaprenyl diphosphate synthase subunit 1	0.0025	0.0407	0.044
Echinococcus multilocularis	lamin	0.0028	0.0459	0.0518
Trichomonas vaginalis	conserved hypothetical protein	0.0109	0.2243	1
Entamoeba histolytica	hypothetical protein	0.0024	0.0385	0.3899
Trichomonas vaginalis	sugar transporter, putative	0.0034	0.0593	0.2252
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0188	0.0111
Brugia malayi	hypothetical protein	0.0015	0.0188	0.0144
Trichomonas vaginalis	lysyl-tRNA synthetase, putative	0.0021	0.0319	0.0967
Brugia malayi	Sugar transporter family protein	0.0015	0.0188	0.0144
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0034	0.0593	0.282
Trypanosoma cruzi	GTP-binding nuclear protein rtb2, putative	0.0022	0.0329	0.0811
Schistosoma mansoni	lysyl-tRNA synthetase	0.0024	0.0385	0.0407

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (functional)	= 12 uM	Evaluated for its ability to inhibit LPS stimulated production of TNF-alpha in rat whole blood	ChEMBL.	12113803
Inhibition (functional)	= 7.6 %	TNF-alpha inhibiting activity by in vivo inhibition of serum TNF production in rat at 50mg/kg, per oral administration.	ChEMBL.	12113803

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.

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External resources for this compound

ChEMBL: CHEMBL58980

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 83854