TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 386.658 | Formula: C15H16ClIN2
H donors: 1 H acceptors: 0 LogP: 5.12 Rotable bonds: 3
Rule of 5 violations (Lipinski): 1
SMILES: CCCC[n+]1ccc2c(c1)[nH]c1c2cc(cc1)Cl.[I-]
InChi: 1S/C15H15ClN2.HI/c1-2-3-7-18-8-6-12-13-9-11(16)4-5-14(13)17-15(12)10-18;/h4-6,8-10H,2-3,7H2,1H3;1H
InChiKey: OULLMOLCXBHKPH-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
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0097	0.0632	0.0592
Toxoplasma gondii	aldehyde dehydrogenase	0.0061	0.0359	0.2552
Echinococcus granulosus	dna polymerase kappa	0.0064	0.0386	0.0346
Echinococcus granulosus	zinc finger protein	0.0027	0.0104	0.0062
Echinococcus multilocularis	phosphoglycerate kinase 1	0.0095	0.0617	0.0577
Onchocerca volvulus		0.0093	0.0608	0.5697
Trypanosoma cruzi	DNA polymerase eta, putative	0.0064	0.0386	0.6092
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0097	0.0632	0.0592
Entamoeba histolytica	hypothetical protein	0.0027	0.0101	0.065
Onchocerca volvulus		0.0077	0.0485	0.3309
Giardia lamblia	DINP protein human, muc B family	0.0064	0.0386	0.5938
Brugia malayi	CXXC zinc finger family protein	0.0093	0.0608	0.1736
Brugia malayi	Phosphoglycerate kinase	0.0035	0.0162	0.0349
Trichomonas vaginalis	dullard protein, putative	0.0042	0.0215	0.2819
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.0021	0.0059	0.0035
Brugia malayi	beta-lactamase family protein	0.0077	0.0485	0.1355
Schistosoma mansoni	eukaryotic translation initiation factor 4h	0.0443	0.3263	0.3263
Brugia malayi	Bromodomain containing protein	0.0089	0.0572	0.1624
Trichomonas vaginalis	D-aminoacylase, putative	0.0077	0.0485	0.7653
Schistosoma mansoni	DNA polymerase IV / kappa	0.002	0.005	0.005
Trypanosoma brucei	chrX additional, unordered contigs	0.002	0.005	0.0379
Trypanosoma brucei	DNA damage repair protein, putative	0.002	0.005	0.0379
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0064	0.0386	0.6092
Schistosoma mansoni	hypothetical protein	0.0045	0.0242	0.0242
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0064	0.0386	0.6092
Loa Loa (eye worm)	hypothetical protein	0.0053	0.0299	0.0781
Mycobacterium ulcerans	hypothetical protein	0.0077	0.0485	0.7683
Leishmania major	hypothetical protein, conserved	0.0042	0.0215	0.318
Brugia malayi	Phosphoglycerate kinase	0.0095	0.0617	0.1764
Mycobacterium tuberculosis	Probable aldehyde dehydrogenase	0.0061	0.0359	0.0841
Schistosoma mansoni	cpg binding protein	0.0101	0.0664	0.0664
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0061	0.0359	0.5457
Loa Loa (eye worm)	hypothetical protein	0.0314	0.2286	0.6962
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0097	0.0632	0.0592
Echinococcus multilocularis	disco interacting protein 2	0.0026	0.0095	0.0053
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	0.0021	0.0057	0.003
Toxoplasma gondii	histone lysine methyltransferase SET1	0.018	0.1262	1
Echinococcus granulosus	bromodomain adjacent to zinc finger domain	0.0072	0.0443	0.0402
Brugia malayi	Niemann-Pick C1 protein precursor	0.0109	0.0729	0.2115
Loa Loa (eye worm)	hypothetical protein	0.0058	0.0335	0.0895
Echinococcus multilocularis	muscleblind protein	0.0314	0.2286	0.2254
Trypanosoma cruzi	hypothetical protein, conserved	0.0077	0.0485	0.7771
Schistosoma mansoni	terminal deoxycytidyl transferase	0.0064	0.0386	0.0386
Trypanosoma brucei	hypothetical protein, conserved	0.002	0.005	0.0379
Mycobacterium tuberculosis	Probable fatty-acid-AMP ligase FadD21 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.0026	0.0095	0.0105
Brugia malayi	beta-lactamase	0.0077	0.0485	0.1355
Trichomonas vaginalis	dullard protein, putative	0.0042	0.0215	0.2819
Trypanosoma brucei	DNA polymerase IV, putative	0.0064	0.0386	0.6092
Trichomonas vaginalis	conserved hypothetical protein	0.0021	0.0059	0.0035
Mycobacterium leprae	Probable fatty-acid-CoA synthetase FadD28 (fatty-acid-CoA ligase) (fatty-acid-CoA synthase)	0.0026	0.0095	0.0235
Leishmania major	DNA polymerase kappa, putative,DNA polymerase IV, putative	0.0064	0.0386	0.6092
Trypanosoma brucei	Mitochondrial import inner membrane translocase subunit TIM50	0.0042	0.0215	0.318
Schistosoma mansoni	hypothetical protein	0.0041	0.0211	0.0211
Entamoeba histolytica	Niemann-Pick C1 protein, putative	0.0109	0.0729	1
Trypanosoma brucei	hypothetical protein, conserved	0.002	0.005	0.0379
Echinococcus multilocularis	Carboxy terminal domain RNA polymerase II	0.0042	0.0215	0.0173
Schistosoma mansoni	rab geranylgeranyl transferase alpha subunit	0.0064	0.0386	0.0386
Schistosoma mansoni	phosphoglycerate kinase	0.0095	0.0617	0.0617
Mycobacterium ulcerans	acyl-CoA synthetase	0.0026	0.0095	0.0792
Schistosoma mansoni	phosphoglycerate kinase	0.0095	0.0617	0.0617
Leishmania major	DNA polymerase eta, putative	0.0064	0.0386	0.6092
Mycobacterium ulcerans	DNA polymerase IV	0.0064	0.0386	0.5938
Trypanosoma brucei	importin beta-1 subunit, putative	0.0033	0.0148	0.2046
Schistosoma mansoni	cpg binding protein	0.0093	0.0608	0.0608
Brugia malayi	CHE-14 protein	0.0047	0.0255	0.0638
Echinococcus multilocularis	mixed lineage leukemia protein mll	0.0023	0.0074	0.0032
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0021	0.0058	0.0016
Brugia malayi	beta-lactamase family protein	0.0077	0.0485	0.1355
Echinococcus granulosus	Protein patched homolog 1	0.0047	0.0255	0.0214
Schistosoma mansoni	DNA polymerase eta	0.0064	0.0386	0.0386
Trichomonas vaginalis	Importin beta-1 subunit, putative	0.0027	0.0101	0.0781
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0064	0.0386	0.0917
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0093	0.0608	0.1742
Giardia lamblia	Endonuclease/Exonuclease/phosphatase	0.0021	0.0057	0.0128
Echinococcus multilocularis	bromodomain adjacent to zinc finger domain	0.0072	0.0443	0.0402
Loa Loa (eye worm)	hypothetical protein	0.0043	0.0222	0.0543
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0058	0.0032
Schistosoma mansoni	methyl-cpg binding protein mbd	0.0019	0.0042	0.0042
Loa Loa (eye worm)	hypothetical protein	0.0122	0.0828	0.2427
Plasmodium vivax	importin-beta 2, putative	0.0033	0.0148	0.1733
Loa Loa (eye worm)	hypothetical protein	0.0045	0.0242	0.0606
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.0021	0.0059	0.0035
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.005	0.0379
Schistosoma mansoni	disco-interacting protein 2 (dip2)	0.0026	0.0095	0.0095
Mycobacterium ulcerans	exodeoxyribonuclease III protein XthA	0.0021	0.0057	0.0128
Trypanosoma brucei	DNA polymerase kappa, putative	0.0064	0.0386	0.6092
Toxoplasma gondii	HEAT repeat-containing protein	0.0033	0.0148	0.081
Trichomonas vaginalis	DNA polymerase IV / kappa, putative	0.0064	0.0386	0.5885
Echinococcus multilocularis	fetal alzheimer antigen, falz	0.003	0.0129	0.0087
Mycobacterium tuberculosis	Conserved protein	0.0077	0.0485	0.1192
Mycobacterium ulcerans	DNA polymerase IV	0.0064	0.0386	0.5938
Toxoplasma gondii	ABC1 family protein	0.0077	0.0485	0.3592
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0023	0.0074	0.0032
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0255	0.0645
Mycobacterium tuberculosis	Fatty-acid-AMP ligase FadD26 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.0026	0.0095	0.0105
Trichomonas vaginalis	helicase, putative	0.0021	0.0059	0.0035
Loa Loa (eye worm)	beta-lactamase	0.0077	0.0485	0.1361
Trypanosoma brucei	hypothetical protein, conserved	0.0077	0.0485	0.7771
Giardia lamblia	Nuclear LIM interactor-interacting factor 1	0.0042	0.0215	0.2912
Trichomonas vaginalis	penicillin-binding protein, putative	0.0077	0.0485	0.7653
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0077	0.0485	0.0445
Trypanosoma brucei	DNA polymerase kappa, putative	0.0064	0.0386	0.6092
Trypanosoma cruzi	phosphoglycerate kinase, putative	0.0095	0.0617	1
Schistosoma mansoni	patched 1	0.0047	0.0255	0.0255
Trypanosoma brucei	phosphoglycerate kinase	0.0035	0.0162	0.2284
Trichomonas vaginalis	nuclear lim interactor-interacting factor, putative	0.0042	0.0215	0.2819
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0021	0.0058	0.0058
Mycobacterium tuberculosis	Probable lipase LipE	0.0077	0.0485	0.1192
Trichomonas vaginalis	conserved hypothetical protein	0.0047	0.0255	0.3536
Mycobacterium tuberculosis	Probable fatty-acid-AMP ligase FadD24 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.0024	0.0082	0.007
Trypanosoma cruzi	PAS-domain containing phosphoglycerate kinase, putative	0.0035	0.0162	0.2284
Echinococcus multilocularis	tumor protein p63	0.0375	0.275	0.272
Brugia malayi	Muscleblind-like protein	0.0314	0.2286	0.696
Echinococcus granulosus	mixed lineage leukemia protein mll	0.0023	0.0074	0.0032
Leishmania major	importin beta-1 subunit, putative	0.0027	0.0101	0.1245
Leishmania major	PAS-domain containing phosphoglycerate kinase, putative	0.0035	0.0162	0.2284
Trichomonas vaginalis	conserved hypothetical protein	0.0021	0.0059	0.0035
Trichomonas vaginalis	conserved hypothetical protein	0.0021	0.0059	0.0035
Plasmodium vivax	NLI interacting factor-like phosphatase, putative	0.0042	0.0215	0.2912
Leishmania major	hypothetical protein, conserved	0.0077	0.0485	0.7771
Loa Loa (eye worm)	hypothetical protein	0.0077	0.0485	0.1361
Loa Loa (eye worm)	hypothetical protein	0.0095	0.0617	0.177
Trypanosoma cruzi	DNA damage repair protein, putative	0.002	0.005	0.0379
Echinococcus multilocularis	DNA (apurinic or apyrimidinic site) lyase	0.0021	0.0057	0.0015
Echinococcus multilocularis		0.0042	0.0215	0.0173
Entamoeba histolytica	phosphoglycerate kinase, putative	0.0095	0.0617	0.8323
Echinococcus granulosus	expressed conserved protein	0.0103	0.0679	0.0639
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0215	0.052
Chlamydia trachomatis	phosphoglycerate kinase	0.0095	0.0617	0.5
Leishmania major	aldehyde dehydrogenase, mitochondrial precursor	0.0061	0.0359	0.563
Trypanosoma brucei	phosphoglycerate kinase, putative	0.0035	0.0162	0.2284
Schistosoma mansoni	niemann-pick C1 (NPC1)	0.0111	0.0742	0.0742
Trypanosoma cruzi	hypothetical protein, conserved	0.002	0.005	0.0379
Echinococcus multilocularis	cpg binding protein	0.0101	0.0664	0.0625
Mycobacterium tuberculosis	Probable phosphoglycerate kinase Pgk	0.0095	0.0617	0.1558
Onchocerca volvulus		0.0077	0.0485	0.3309
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0021	0.0059	0.0035
Echinococcus multilocularis	aldehyde dehydrogenase, mitochondrial	0.0061	0.0359	0.0318
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0026	0.0095	0.0792
Echinococcus granulosus	terminal deoxycytidyl transferase rev1	0.0064	0.0386	0.0346
Mycobacterium leprae	Probable fatty-acid-CoA synthetase FadD29 (fatty-acid-CoA ligase) (fatty-acid-CoA synthase)	0.0026	0.0095	0.0235
Trypanosoma brucei	DNA polymerase kappa, putative	0.0044	0.0235	0.3521
Mycobacterium leprae	FATTY-ACID-CoA LIGASE FADD26 (FATTY-ACID-COA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0026	0.0095	0.0235
Echinococcus multilocularis	sterol regulatory element binding protein	0.0047	0.0255	0.0214
Trypanosoma cruzi	hypothetical protein, conserved	0.0077	0.0485	0.7771
Echinococcus granulosus	geminin	0.0557	0.4129	0.4105
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0097	0.0632	0.0592
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0095	0.0147
Mycobacterium ulcerans	acyl-CoA synthetase	0.0026	0.0095	0.0792
Schistosoma mansoni	eukaryotic translation initiation factor 4h	0.0443	0.3263	0.3263
Echinococcus granulosus	snurportin 1	0.0351	0.2564	0.2532
Trypanosoma cruzi	DNA damage repair protein, putative	0.002	0.005	0.0379
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0077	0.0485	0.1355
Brugia malayi	Bromodomain containing protein	0.0043	0.0222	0.0535
Loa Loa (eye worm)	hypothetical protein	0.0443	0.3263	1
Trichomonas vaginalis	nuclear lim interactor-interacting factor, putative	0.0042	0.0215	0.2819
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0097	0.0632	0.0632
Mycobacterium tuberculosis	Possible conserved lipoprotein LpqK	0.0077	0.0485	0.1192
Echinococcus multilocularis	Niemann Pick C1 protein	0.0109	0.0729	0.069
Schistosoma mansoni	methyl-cpg binding protein mbd	0.0019	0.0042	0.0042
Plasmodium vivax	phosphoglycerate kinase, putative	0.0095	0.0617	1
Schistosoma mansoni	importin beta-1	0.0033	0.0148	0.0148
Mycobacterium ulcerans	esterase/lipase LipP	0.0077	0.0485	0.7683
Leishmania major	DNA polymerase kappa, putative	0.002	0.005	0.0379
Echinococcus multilocularis	snurportin 1	0.0351	0.2564	0.2532
Trypanosoma brucei	DNA damage repair protein, putative	0.002	0.005	0.0379
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0061	0.0359	0.5457
Trypanosoma brucei	DNA polymerase kappa, putative	0.0064	0.0386	0.6092
Trichomonas vaginalis	phosphoglycerate kinase, putative	0.0095	0.0617	1
Toxoplasma gondii	phosphoglycerate kinase PGKII	0.0095	0.0617	0.4675
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0097	0.0632	0.1817
Schistosoma mansoni	hypothetical protein	0.0045	0.0242	0.0242
Trichomonas vaginalis	dullard protein, putative	0.0042	0.0215	0.2819
Loa Loa (eye worm)	histone methyltransferase	0.0029	0.0118	0.0219
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0077	0.0485	0.1361
Mycobacterium ulcerans	beta-lactamase	0.0077	0.0485	0.7683
Schistosoma mansoni	hypothetical protein	0.0351	0.2564	0.2564
Trypanosoma brucei	apurinic/apyrimidinic endonuclease, putative	0.0021	0.0057	0.0503
Trypanosoma cruzi	phosphoglycerate kinase, putative	0.0035	0.0162	0.2284
Mycobacterium ulcerans	putative fatty-acid--CoA ligase	0.0026	0.0095	0.0792
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0097	0.0632	0.0632
Schistosoma mansoni	acetyl-CoA C-acetyltransferase	0.003	0.0129	0.0129
Trichomonas vaginalis	esterase, putative	0.0077	0.0485	0.7653
Brugia malayi	Carboxy-terminal domain RNA polymerase II polypeptide A smallphosphatase 1	0.0042	0.0215	0.0514
Echinococcus granulosus	fetal alzheimer antigen falz	0.003	0.0129	0.0087
Trypanosoma cruzi	DNA polymerase eta, putative	0.002	0.005	0.0379
Trypanosoma brucei	DNA polymerase kappa, putative	0.0064	0.0386	0.6092
Mycobacterium ulcerans	long-chain-fatty-acid--CoA ligase	0.0026	0.0095	0.0792
Brugia malayi	RNA binding protein	0.0443	0.3263	1
Schistosoma mansoni	hypothetical protein	0.0557	0.4129	0.4129
Loa Loa (eye worm)	hypothetical protein	0.0077	0.0485	0.1361
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0021	0.0059	0.0035
Trypanosoma brucei	phosphoglycerate kinase	0.0095	0.0617	1
Toxoplasma gondii	phosphoglycerate kinase PGKI	0.0095	0.0617	0.4675
Schistosoma mansoni	hypothetical protein	0.0017	0.0027	0.0027
Loa Loa (eye worm)	hypothetical protein	0.002	0.005	0.0007
Leishmania major	DNA damage repair protein, putative	0.002	0.005	0.0379
Leishmania major	DNA polymerase kappa, putative	0.0064	0.0386	0.6092
Schistosoma mansoni	aldehyde dehydrogenase	0.0061	0.0359	0.0359
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0077	0.0485	0.0485
Brugia malayi	Disco-interacting protein 2 homolog	0.0026	0.0095	0.014
Schistosoma mansoni	cpg binding protein	0.0101	0.0664	0.0664
Schistosoma mansoni	bromodomain containing protein	0.0076	0.0473	0.0473
Echinococcus granulosus	DNA apurinic or apyrimidinic site lyase	0.0021	0.0057	0.0015
Giardia lamblia	Phosphoglycerate kinase	0.0095	0.0617	1
Echinococcus granulosus	aldehyde dehydrogenase mitochondrial	0.0061	0.0359	0.0318
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0021	0.0059	0.0035
Echinococcus multilocularis	bromodomain adjacent to zinc finger domain	0.004	0.0202	0.016
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0023	0.0074	0.0032
Trichomonas vaginalis	D-aminoacylase, putative	0.0077	0.0485	0.7653
Loa Loa (eye worm)	hypothetical protein	0.0122	0.0828	0.2427
Echinococcus multilocularis	protein dispatched 1	0.0054	0.0305	0.0264
Trichomonas vaginalis	D-aminoacylase, putative	0.0077	0.0485	0.7653
Onchocerca volvulus		0.0077	0.0485	0.3309
Echinococcus multilocularis	Niemann Pick C1 protein	0.0156	0.1086	0.1048
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0021	0.0059	0.0035
Leishmania major	DNA polymerase eta, putative	0.002	0.005	0.0379
Leishmania major	apurinic/apyrimidinic endonuclease-redox protein	0.0021	0.0057	0.0503
Mycobacterium tuberculosis	Probable fatty-acid-AMP ligase FadD25 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.0026	0.0095	0.0105
Trypanosoma brucei	phosphoglycerate kinase	0.0095	0.0617	1
Mycobacterium tuberculosis	Fatty-acid-AMP ligase FadD28 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.0026	0.0095	0.0105
Mycobacterium ulcerans	acyl-CoA synthetase	0.0026	0.0095	0.0792
Plasmodium falciparum	NLI interacting factor-like phosphatase, putative	0.0042	0.0215	0.2912
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0064	0.0386	0.6092
Trypanosoma cruzi	phosphoglycerate kinase, putative	0.0035	0.0162	0.2284
Trichomonas vaginalis	nuclear lim interactor-interacting factor, putative	0.0042	0.0215	0.2819
Plasmodium vivax	hypothetical protein, conserved	0.0077	0.0485	0.7683
Onchocerca volvulus	Huntingtin homolog	0.0122	0.0828	1
Schistosoma mansoni	cellular tumor antigen P53	0.0055	0.0316	0.0316
Trypanosoma brucei	unspecified product	0.0044	0.0235	0.3521
Loa Loa (eye worm)	hypothetical protein	0.0064	0.0386	0.1054
Entamoeba histolytica	deoxycytidyl transferase, putative	0.0064	0.0386	0.4898
Schistosoma mansoni	ap endonuclease	0.0021	0.0057	0.0057
Trichomonas vaginalis	nuclear lim interactor-interacting factor, putative	0.0042	0.0215	0.2819
Trichomonas vaginalis	conserved hypothetical protein	0.0021	0.0059	0.0035
Echinococcus multilocularis	geminin	0.0557	0.4129	0.4105
Loa Loa (eye worm)	nucleolar RNA-associated protein alpha	0.0351	0.2564	0.7825
Mycobacterium tuberculosis	Probable lipase LipD	0.0077	0.0485	0.1192
Mycobacterium tuberculosis	Conserved protein	0.0077	0.0485	0.1192
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0029	0.0118	0.0076
Plasmodium vivax	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0021	0.0057	0.0128
Trypanosoma brucei	unspecified product	0.0044	0.0235	0.3521
Mycobacterium tuberculosis	Fatty-acid-AMP ligase FadD29 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.0026	0.0095	0.0105
Trypanosoma cruzi	3-phosphoglycerate kinase, glycosomal	0.0035	0.0162	0.2284
Trypanosoma cruzi	importin beta-1 subunit, putative	0.0027	0.0101	0.1245
Trypanosoma brucei	importin beta-1 subunit, putative	0.0033	0.0148	0.2046
Brugia malayi	ImpB/MucB/SamB family protein	0.0064	0.0386	0.1047
Mycobacterium tuberculosis	Probable acyl-CoA ligase FadD31 (acyl-CoA synthetase) (acyl-CoA synthase)	0.0026	0.0095	0.0105
Loa Loa (eye worm)	hypothetical protein	0.0077	0.0485	0.1361
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0021	0.0059	0.0035
Echinococcus granulosus	importin subunit beta 1	0.0033	0.0148	0.0106
Wolbachia endosymbiont of Brugia malayi	phosphoglycerate kinase	0.0095	0.0617	1
Trichomonas vaginalis	Importin beta-1 subunit, putative	0.0027	0.0101	0.0781
Echinococcus multilocularis	dna polymerase kappa	0.0064	0.0386	0.0346
Trypanosoma brucei	DNA polymerase kappa, putative	0.0064	0.0386	0.6092
Trypanosoma brucei	DNA polymerase kappa, putative	0.0064	0.0386	0.6092
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0023	0.0074	0.0074
Loa Loa (eye worm)	hypothetical protein	0.0041	0.0211	0.0508
Schistosoma mansoni	zinc finger protein	0.0017	0.0027	0.0027
Trichomonas vaginalis	penicillin-binding protein, putative	0.0077	0.0485	0.7653
Trypanosoma brucei	DNA polymerase kappa, putative	0.0064	0.0386	0.6092
Mycobacterium tuberculosis	Probable hydrolase	0.0077	0.0485	0.1192
Mycobacterium tuberculosis	Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed))	0.0064	0.0386	0.0917
Schistosoma mansoni	aldehyde dehydrogenase	0.0061	0.0359	0.0359
Loa Loa (eye worm)	hypothetical protein	0.0079	0.0495	0.1392
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0064	0.0386	0.6092
Trichomonas vaginalis	conserved hypothetical protein	0.0021	0.0059	0.0035
Echinococcus granulosus	tumor protein p63	0.0375	0.275	0.272
Brugia malayi	F/Y-rich N-terminus family protein	0.0031	0.0131	0.0253
Trypanosoma brucei	DNA polymerase kappa, putative	0.0044	0.0235	0.3521
Brugia malayi	PHD-finger family protein	0.0033	0.0149	0.0309
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.005	0.0379
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0494	0.3648	1
Mycobacterium tuberculosis	Fatty-acid-AMP ligase FadD32 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase). Also shown to have acyl-ACP ligase activity.	0.0026	0.0095	0.0105
Mycobacterium leprae	Probable phosphoglycerate kinase Pgk	0.0095	0.0617	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0064	0.0386	0.6092
Echinococcus multilocularis	muscleblind protein 1	0.0314	0.2286	0.2254
Mycobacterium tuberculosis	Conserved protein	0.0077	0.0485	0.1192
Echinococcus multilocularis	terminal deoxycytidyl transferase rev1	0.0064	0.0386	0.0346
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0021	0.0058	0.0058
Echinococcus granulosus	Niemann Pick C1 protein	0.0109	0.0729	0.069
Echinococcus granulosus	Carboxy terminal domain RNA polymerase II	0.0042	0.0215	0.0173
Trichomonas vaginalis	conserved hypothetical protein	0.0021	0.0059	0.0035
Trypanosoma cruzi	hypothetical protein, conserved	0.0042	0.0215	0.318
Leishmania major	phosphoglycerate kinase C, glycosomal	0.0095	0.0617	1
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0097	0.0632	0.1811
Loa Loa (eye worm)	PHD-finger family protein	0.0023	0.0072	0.0078
Echinococcus granulosus	sterol regulatory element binding protein	0.0047	0.0255	0.0214
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0021	0.0059	0.0035
Loa Loa (eye worm)	abnormal chemotaxis protein 14	0.0047	0.0255	0.0645
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0095	0.0147
Mycobacterium ulcerans	fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE	0.0077	0.0485	0.7683
Leishmania major	phosphoglycerate kinase B, cytosolic	0.0095	0.0617	1
Brugia malayi	RNA, U transporter 1	0.0093	0.0608	0.1738
Echinococcus granulosus	phosphoglycerate kinase 1	0.0095	0.0617	0.0577
Echinococcus granulosus	CTD small phosphatase protein like	0.0042	0.0215	0.0173
Trypanosoma cruzi	hypothetical protein, conserved	0.002	0.005	0.0379
Trypanosoma brucei	unspecified product	0.0064	0.0386	0.6092
Toxoplasma gondii	Dullard family phosphatase domain-containing protein	0.0042	0.0215	0.1361
Mycobacterium ulcerans	acyl-CoA synthetase	0.0026	0.0095	0.0792
Schistosoma mansoni	ap endonuclease	0.0021	0.0057	0.0057
Schistosoma mansoni	nuclear lim interactor-interacting factor (nli-interacting factor) (nli-if)	0.0042	0.0215	0.0215
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0061	0.0359	0.5457
Echinococcus multilocularis	expressed conserved protein	0.0103	0.0679	0.0639
Plasmodium vivax	NLI interacting factor-like phosphatase, putative	0.0042	0.0215	0.2912
Loa Loa (eye worm)	hypothetical protein	0.0109	0.0729	0.212
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0198	0.1403	0.1403
Trichomonas vaginalis	conserved hypothetical protein	0.0021	0.0059	0.0035
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0148	0.0313
Entamoeba histolytica	NLI interacting factor-like phosphatase domain-containing protein	0.0042	0.0215	0.2347
Toxoplasma gondii	exonuclease III APE	0.0021	0.0057	0.006
Plasmodium falciparum	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0021	0.0057	0.0128
Trichomonas vaginalis	DNA polymerase eta, putative	0.0064	0.0386	0.5885
Echinococcus multilocularis	dna polymerase eta	0.0064	0.0386	0.0346
Echinococcus granulosus	histone lysine methyltransferase setb	0.0021	0.0058	0.0016
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease, putative	0.0021	0.0057	0.0503
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0077	0.0485	0.0485
Echinococcus multilocularis	zinc finger protein	0.0027	0.0104	0.0062
Echinococcus granulosus	disco interacting protein 2	0.0026	0.0095	0.0053
Brugia malayi	ImpB/MucB/SamB family protein	0.0064	0.0386	0.1047
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0029	0.0118	0.0076
Schistosoma mansoni	hypothetical protein	0.0045	0.0242	0.0242
Echinococcus granulosus	beta LACTamase domain containing family member	0.0077	0.0485	0.0445
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0097	0.0632	0.0632
Mycobacterium ulcerans	lipase LipD	0.0077	0.0485	0.7683
Plasmodium falciparum	phosphoglycerate kinase	0.0095	0.0617	1
Mycobacterium ulcerans	phosphoglycerate kinase	0.0095	0.0617	1
Echinococcus granulosus	muscleblind protein	0.0314	0.2286	0.2254
Schistosoma mansoni	hypothetical protein	0.133	1	1
Schistosoma mansoni	hypothetical protein	0.0045	0.0242	0.0242
Schistosoma mansoni	hypothetical protein	0.0557	0.4129	0.4129
Loa Loa (eye worm)	hypothetical protein	0.0077	0.0485	0.1361
Trypanosoma cruzi	PAS-domain containing phosphoglycerate kinase, putative	0.0035	0.0162	0.2284
Plasmodium falciparum	importin beta, putative	0.0033	0.0148	0.1733
Echinococcus granulosus	bromodomain adjacent to zinc finger domain	0.004	0.0202	0.016
Mycobacterium tuberculosis	Probable fatty-acid-AMP ligase FadD23 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.0024	0.0082	0.007
Mycobacterium leprae	Probable lipase LipE	0.0077	0.0485	0.7543
Trypanosoma brucei	DNA polymerase kappa, putative	0.0064	0.0386	0.6092
Trypanosoma brucei	DNA polymerase eta, putative	0.0064	0.0386	0.6092
Loa Loa (eye worm)	hypothetical protein	0.0077	0.0485	0.1361
Trypanosoma cruzi	phosphoglycerate kinase, putative	0.0095	0.0617	1
Mycobacterium leprae	conserved hypothetical protein	0.0077	0.0485	0.7543
Echinococcus granulosus	Eukaryotic translation initiation factor 4H	0.0443	0.3263	0.3235
Echinococcus multilocularis	protein patched	0.0047	0.0255	0.0214
Loa Loa (eye worm)	hypothetical protein	0.0055	0.0316	0.0834
Trichomonas vaginalis	conserved hypothetical protein	0.0021	0.0059	0.0035
Loa Loa (eye worm)	hypothetical protein	0.0077	0.0485	0.1361
Mycobacterium tuberculosis	Probable esterase LipL	0.0077	0.0485	0.1192
Trichomonas vaginalis	phosphoglycerate kinase, putative	0.0095	0.0617	1
Echinococcus multilocularis	importin subunit beta 1	0.0033	0.0148	0.0106
Echinococcus granulosus	cpg binding protein	0.0101	0.0664	0.0625
Mycobacterium leprae	PROBABLE FATTY-ACID--CoA LIGASE FADD21 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0026	0.0095	0.0235
Trypanosoma brucei	DNA polymerase kappa, putative	0.0044	0.0235	0.3521
Trypanosoma brucei	DNA polymerase kappa, putative	0.0064	0.0386	0.6092
Brugia malayi	exodeoxyribonuclease III family protein	0.0021	0.0057	0.0023
Schistosoma mansoni	hypothetical protein	0.0023	0.0072	0.0072
Schistosoma mansoni	zinc finger protein	0.0027	0.0104	0.0104
Brugia malayi	hypothetical protein	0.0122	0.0828	0.2422
Loa Loa (eye worm)	ImpB/MucB/SamB family protein	0.0064	0.0386	0.1054
Echinococcus multilocularis	dnaJ subfamily B	0.133	1	1
Echinococcus granulosus	dna polymerase eta	0.0064	0.0386	0.0346
Mycobacterium tuberculosis	Probable conserved lipoprotein	0.0077	0.0485	0.1192
Trypanosoma brucei	DNA polymerase IV, putative	0.0064	0.0386	0.6092
Mycobacterium tuberculosis	Probable esterase/lipase LipP	0.0077	0.0485	0.1192
Trypanosoma brucei	DNA polymerase IV, putative	0.0064	0.0386	0.6092
Onchocerca volvulus	Huntingtin homolog	0.0122	0.0828	1
Trichomonas vaginalis	conserved hypothetical protein	0.0021	0.0059	0.0035
Schistosoma mansoni	nuclear lim interactor-interacting factor (nli-interacting factor) (nli-if)	0.0042	0.0215	0.0215
Echinococcus multilocularis	Eukaryotic translation initiation factor 4H	0.0443	0.3263	0.3235
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease	0.0021	0.0057	0.0503
Treponema pallidum	phosphoglycerate kinase	0.0095	0.0617	1
Echinococcus granulosus	Niemann Pick C1 protein	0.0156	0.1086	0.1048
Loa Loa (eye worm)	hypothetical protein	0.0314	0.2286	0.6962
Brugia malayi	Importin beta-1 subunit	0.0033	0.0148	0.0306
Trichomonas vaginalis	importin beta-1, putative	0.0027	0.0101	0.0781
Schistosoma mansoni	eukaryotic translation initiation factor 4h	0.0443	0.3263	0.3263

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (functional)	= 1.616 uM	Antiparasitic activity against Plasmodium falciparum K1	ChEMBL.	20133138
IC50 (functional)	= 11.6 uM	Antiparasitic activity against Trypanosoma brucei rhodesiense STIB 900	ChEMBL.	20133138
IC50 (functional)	= 103.8 uM	Antiparasitic activity against Trypanosoma cruzi Tulahuen C2C4	ChEMBL.	20133138
IC50 (functional)	= 112.1 uM	Antiparasitic activity against Leishmania donovani MHOM-ET-67/L82 axenic amastigotes	ChEMBL.	20133138

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Trypanosoma brucei gambiense		20133138
Plasmodium falciparum		20133138

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: CHEMBL598402

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1094483