TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 369.285 | Formula: C18H22Cl2N2O2
H donors: 0 H acceptors: 1 LogP: 3.7 Rotable bonds: 10
Rule of 5 violations (Lipinski): 1
SMILES: ClCCN(CCCl)CCOC(=O)C1=CN(C=CC1)c1ccccc1
InChi: 1S/C18H22Cl2N2O2/c19-8-11-21(12-9-20)13-14-24-18(23)16-5-4-10-22(15-16)17-6-2-1-3-7-17/h1-4,6-7,10,15H,5,8-9,11-14H2
InChiKey: ROIVZIXBFYSVFW-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
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0044	0.0394	0.0604
Mycobacterium tuberculosis	Putative ferredoxin reductase	0.0085	0.0925	0.1558
Loa Loa (eye worm)	hypothetical protein	0.0073	0.0772	0.1199
Schistosoma mansoni	endoplasmin	0.0028	0.0196	0.0292
Trypanosoma cruzi	heat shock protein 85, putative	0.0028	0.0196	0.0193
Loa Loa (eye worm)	hypothetical protein	0.0073	0.0772	0.1199
Chlamydia trachomatis	DNA gyrase subunit B	0.0028	0.0196	1
Trypanosoma cruzi	Present in the outer mitochondrial membrane proteome 4	0.0037	0.0309	0.0372
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0134	0.1557	0.2436
Schistosoma mansoni	hypothetical protein	0.0065	0.0664	0.1028
Echinococcus granulosus	heat shock protein	0.0028	0.0196	0.0292
Trypanosoma brucei	heat shock protein, putative	0.0028	0.0196	0.0309
Mycobacterium tuberculosis	Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras	0.0094	0.1047	0.1768
Mycobacterium ulcerans	acyl-CoA synthetase	0.0021	0.0097	0.0901
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0019	0.0075	0.0095
Trypanosoma cruzi	DNA topoisomerase II, putative	0.0028	0.0196	0.0193
Leishmania major	heat shock protein 83-1	0.0028	0.0196	0.0193
Echinococcus granulosus	beta LACTamase domain containing family member	0.0073	0.0772	0.1199
Mycobacterium tuberculosis	Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB	0.0085	0.0925	0.1558
Brugia malayi	beta-lactamase	0.0073	0.0772	0.1199
Echinococcus multilocularis	thioredoxin glutathione reductase	0.0038	0.0318	0.0308
Loa Loa (eye worm)	cytochrome P450 family protein	0.002	0.0085	0.0118
Leishmania major	hypothetical protein, conserved	0.0073	0.0772	0.1109
Trichomonas vaginalis	DNA topoisomerase II, putative	0.0028	0.0196	0.1671
Trypanosoma brucei	heat shock protein, putative	0.0028	0.0196	0.0309
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0073	0.0772	0.1199
Schistosoma mansoni	hypothetical protein	0.003	0.0216	0.0324
Onchocerca volvulus		0.0021	0.0097	0.0156
Mycobacterium tuberculosis	Conserved protein	0.0073	0.0772	0.1294
Leishmania major	heat shock protein 83-1	0.0028	0.0196	0.0193
Plasmodium falciparum	DNA topoisomerase 2	0.0028	0.0196	0.5888
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0097	0.0137
Trichomonas vaginalis	D-aminoacylase, putative	0.0073	0.0772	0.9617
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0075	0.0118
Echinococcus granulosus	dna polymerase eta	0.0019	0.0075	0.0102
Loa Loa (eye worm)	hypothetical protein	0.0137	0.1591	0.2488
Schistosoma mansoni	rab6-interacting	0.0019	0.0074	0.0099
Loa Loa (eye worm)	doublecortin family protein	0.0019	0.0074	0.0099
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0021	0.0097	0.0901
Brugia malayi	glutathione reductase	0.0037	0.0312	0.0475
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0044	0.0394	0.0604
Mycobacterium ulcerans	acyl-CoA synthetase	0.0021	0.0097	0.0901
Onchocerca volvulus		0.0137	0.1591	1
Schistosoma mansoni	heat shock protein	0.0028	0.0196	0.0292
Trichomonas vaginalis	conserved hypothetical protein	0.0042	0.0375	0.4138
Entamoeba histolytica	acyl-coA synthetase, putative	0.0021	0.0097	0.0379
Mycobacterium ulcerans	hypothetical protein	0.0021	0.0097	0.0901
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0031	0.0032
Entamoeba histolytica	heat shock protein 90, putative	0.0028	0.0196	0.2058
Trypanosoma brucei	pyruvate dehydrogenase (lipoamide) kinase, putative	0.0177	0.2115	0.3325
Loa Loa (eye worm)	heat shock protein 90	0.0028	0.0196	0.0292
Trypanosoma brucei	DNA polymerase IV, putative	0.0019	0.0075	0.0118
Leishmania major	heat shock protein 83-1	0.0028	0.0196	0.0193
Trichomonas vaginalis	chromobox protein, putative	0.0045	0.0416	0.4706
Mycobacterium ulcerans	two component sensor histidine kinase DevS	0.0028	0.0196	0.2234
Trichomonas vaginalis	esterase, putative	0.0073	0.0772	0.9617
Leishmania major	heat shock protein 83-1	0.0028	0.0196	0.0193
Plasmodium falciparum	endoplasmin, putative	0.0028	0.0196	0.5888
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0075	0.0118
Entamoeba histolytica	heat shock protein 90, putative	0.0028	0.0196	0.2058
Trypanosoma brucei	ERV/ALR sulfhydryl oxidase domain-containing protein	0.0037	0.0309	0.0486
Schistosoma mansoni	pyruvate dehydrogenase	0.0508	0.636	1
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0097	0.0137
Plasmodium vivax	glutathione reductase, putative	0.0037	0.0312	0.3794
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0375	0.0574
Trypanosoma cruzi	hypothetical protein, conserved	0.0073	0.0772	0.1109
Brugia malayi	Heterochromatin protein 1	0.0075	0.08	0.1243
Trypanosoma cruzi	mitochondrial DNA topoisomerase II, putative	0.0028	0.0196	0.0193
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0031	0.0032
Loa Loa (eye worm)	glutathione reductase	0.0037	0.0312	0.0475
Schistosoma mansoni	pyruvate dehydrogenase	0.0479	0.5997	0.9428
Trypanosoma brucei	DNA topoisomerase II beta, putative	0.0028	0.0196	0.0309
Trichomonas vaginalis	sensory transduction histidine kinase, putative	0.0028	0.0196	0.1671
Trypanosoma brucei	DNA polymerase IV, putative	0.0019	0.0075	0.0118
Brugia malayi	Thioredoxin reductase	0.0037	0.0312	0.0475
Echinococcus granulosus	thioredoxin glutathione reductase	0.0038	0.0318	0.0485
Mycobacterium ulcerans	two component system membrane associated sensor kinase	0.0028	0.0196	0.2234
Plasmodium vivax	DNA gyrase subunit B, putative	0.0028	0.0196	0.2234
Leishmania major	heat shock protein 83-1	0.0028	0.0196	0.0193
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0021	0.0097	0.0379
Trypanosoma brucei	heat shock protein 90, putative	0.0028	0.0196	0.0309
Leishmania major	DNA topoisomerase ii	0.0028	0.0196	0.0193
Schistosoma mansoni	loxhd1	0.0019	0.0074	0.0099
Trypanosoma cruzi	DNA topoisomerase II, putative	0.0028	0.0196	0.0193
Trichomonas vaginalis	penicillin-binding protein, putative	0.0073	0.0772	0.9617
Entamoeba histolytica	hypothetical protein	0.0065	0.0664	1
Mycobacterium ulcerans	long-chain-fatty-acid-CoA ligase	0.0021	0.0097	0.0901
Mycobacterium tuberculosis	Possible two component sensor kinase	0.0028	0.0196	0.0304
Trypanosoma cruzi	hypothetical protein, conserved	0.0073	0.0772	0.1109
Mycobacterium ulcerans	two component sensor kinase MprB	0.0028	0.0196	0.2234
Entamoeba histolytica	hypothetical protein	0.0065	0.0664	1
Loa Loa (eye worm)	transcription factor SMAD2	0.0108	0.1222	0.1907
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0065	0.0664	0.0654
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0134	0.1557	0.2436
Plasmodium falciparum	FAD-linked sulfhydryl oxidase ERV1, putative	0.0037	0.0309	0.9901
Brugia malayi	AMP-binding enzyme family protein	0.0021	0.0097	0.0137
Mycobacterium ulcerans	sensor kinase from two component regulatory system	0.0028	0.0196	0.2234
Mycobacterium tuberculosis	Two component sensory transduction histidine kinase MtrB	0.0028	0.0196	0.0304
Schistosoma mansoni	ap endonuclease	0.0036	0.029	0.044
Trichomonas vaginalis	chromobox protein, putative	0.0075	0.08	1
Mycobacterium ulcerans	hypothetical protein	0.0073	0.0772	1
Mycobacterium tuberculosis	Conserved protein	0.0073	0.0772	0.1294
Echinococcus multilocularis	RUN	0.0019	0.0074	0.0063
Mycobacterium tuberculosis	Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase)	0.0021	0.0097	0.0134
Mycobacterium tuberculosis	Two component sensor histidine kinase TrcS	0.0028	0.0196	0.0304
Loa Loa (eye worm)	hypothetical protein	0.0073	0.0772	0.1199
Schistosoma mansoni	polycystin 1-related	0.0019	0.0074	0.0099
Mycobacterium tuberculosis	Probable lipase LipD	0.0073	0.0772	0.1294
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0075	0.0118
Mycobacterium tuberculosis	Two component sensor histidine kinase DevS	0.0028	0.0196	0.0304
Trichomonas vaginalis	sensory transduction histidine kinase bacterial, putative	0.0028	0.0196	0.1671
Toxoplasma gondii	Erv1 / Alr family protein	0.0037	0.0309	0.0495
Plasmodium falciparum	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0036	0.029	0.9232
Plasmodium falciparum	thioredoxin reductase	0.0037	0.0312	1
Brugia malayi	chromobox protein homolog 3	0.0042	0.0375	0.0574
Trypanosoma cruzi	Heat shock protein 83, putative	0.0028	0.0196	0.0193
Trypanosoma brucei	apurinic/apyrimidinic endonuclease, putative	0.0036	0.029	0.0456
Mycobacterium ulcerans	two component sensor histidine kinase PrrB	0.0028	0.0196	0.2234
Trypanosoma brucei	DNA polymerase IV, putative	0.0019	0.0075	0.0118
Loa Loa (eye worm)	hypothetical protein	0.0073	0.0772	0.1199
Plasmodium vivax	hypothetical protein, conserved	0.0073	0.0772	1
Mycobacterium ulcerans	DNA polymerase IV	0.0019	0.0075	0.06
Schistosoma mansoni	thyroid hormone receptor	0.0119	0.1363	0.213
Schistosoma mansoni	heat shock protein	0.0028	0.0196	0.0292
Trichomonas vaginalis	endoplasmin, putative	0.0028	0.0196	0.1671
Onchocerca volvulus		0.0073	0.0772	0.4603
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0134	0.1557	0.1549
Mycobacterium tuberculosis	Probable esterase LipL	0.0073	0.0772	0.1294
Loa Loa (eye worm)	endoplasmin	0.0028	0.0196	0.0292
Schistosoma mansoni	terminal deoxycytidyl transferase	0.0019	0.0075	0.0102
Echinococcus multilocularis	Pyruvate dehydrogenase (lipoamide) kinase	0.0508	0.636	0.6356
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0021	0.0097	0.0134
Mycobacterium ulcerans	two component regulator - sensor kinase	0.0028	0.0196	0.2234
Mycobacterium ulcerans	DNA polymerase IV	0.0019	0.0075	0.06
Plasmodium falciparum	LCCL domain-containing protein	0.0019	0.0074	0.1533
Trichomonas vaginalis	penicillin-binding protein, putative	0.0073	0.0772	0.9617
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0196	0.0292
Onchocerca volvulus		0.0073	0.0772	0.4603
Wolbachia endosymbiont of Brugia malayi	exonuclease III	0.0036	0.029	1
Mycobacterium tuberculosis	Two component sensor histidine kinase DosT	0.0028	0.0196	0.0304
Leishmania major	heat shock protein 83-1	0.0028	0.0196	0.0193
Echinococcus granulosus	dna polymerase kappa	0.0019	0.0075	0.0102
Echinococcus granulosus	DNA topoisomerase 2 alpha	0.0028	0.0196	0.0292
Mycobacterium tuberculosis	Two component sensor kinase MprB	0.0028	0.0196	0.0304
Toxoplasma gondii	ABC1 family protein	0.0073	0.0772	0.2523
Trichomonas vaginalis	D-aminoacylase, putative	0.0073	0.0772	0.9617
Leishmania major	pyruvate dehydrogenase (lipoamide) kinase, putative	0.0177	0.2115	0.3246
Echinococcus multilocularis	FAD linked sulfhydryl oxidase ALR	0.0037	0.0309	0.0299
Onchocerca volvulus	Heterochromatin protein 1 homolog	0.0042	0.0375	0.1986
Plasmodium vivax	hypothetical protein, conserved	0.0028	0.0196	0.2234
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0075	0.0118
Mycobacterium tuberculosis	DNA gyrase (subunit B) GyrB (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (type II DNA topoisomerase)	0.0028	0.0196	0.0304
Trypanosoma cruzi	heat shock protein 85, putative	0.0028	0.0196	0.0193
Schistosoma mansoni	endoplasmin	0.0028	0.0196	0.0292
Mycobacterium ulcerans	two component sensor histidine kinase TrcS	0.0028	0.0196	0.2234
Trichomonas vaginalis	conserved hypothetical protein	0.003	0.0217	0.1955
Leishmania major	heat shock protein 83-1	0.0028	0.0196	0.0193
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0134	0.1557	0.1549
Entamoeba histolytica	hypothetical protein	0.0065	0.0664	1
Leishmania major	hypothetical protein, conserved	0.0037	0.0309	0.0372
Echinococcus multilocularis	heat shock protein	0.0028	0.0196	0.0186
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0134	0.1557	0.2436
Mycobacterium tuberculosis	Probable hydrolase	0.0073	0.0772	0.1294
Chlamydia trachomatis	DNA gyrase subunit B	0.0028	0.0196	1
Schistosoma mansoni	rab6-interacting	0.0019	0.0074	0.0099
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0073	0.0772	0.1199
Trypanosoma cruzi	Histidine kinase-, DNA gyrase B-, and HSP90-like ATPase, putative	0.0028	0.0196	0.0193
Trichomonas vaginalis	chromobox protein, putative	0.0045	0.0416	0.4706
Trypanosoma brucei	Heat shock protein 83, putative	0.0028	0.0196	0.0309
Leishmania major	4-coumarate:coa ligase-like protein	0.0021	0.0097	0.0036
Brugia malayi	heat shock protein 90	0.0028	0.0196	0.0292
Leishmania major	heat shock protein 83-1	0.0028	0.0196	0.0193
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0075	0.0118
Plasmodium vivax	endoplasmin, putative	0.0028	0.0196	0.2234
Trichomonas vaginalis	receptor histidine kinase, putative	0.0028	0.0196	0.1671
Schistosoma mansoni	chromobox protein	0.0075	0.08	0.1243
Brugia malayi	Probable DNA topoisomerase II	0.0028	0.0196	0.0292
Onchocerca volvulus	Putative DNA topoisomerase 2, mitochondrial	0.0028	0.0196	0.0808
Loa Loa (eye worm)	hepatopoietin HPO2	0.0037	0.0309	0.047
Echinococcus multilocularis	heat shock protein 90	0.0028	0.0196	0.0186
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0031	0.0032
Echinococcus granulosus	geminin	0.0183	0.2184	0.3423
Leishmania major	developmentally regulated phosphoprotein-like protein	0.0508	0.636	1
Trypanosoma brucei	DNA topoisomerase II alpha, putative	0.0028	0.0196	0.0309
Mycobacterium tuberculosis	Probable reductase	0.0085	0.0925	0.1558
Echinococcus granulosus	chromobox protein 1	0.0075	0.08	0.1243
Loa Loa (eye worm)	hypothetical protein	0.0073	0.0772	0.1199
Echinococcus granulosus	lipoxygenase domain containing protein	0.0019	0.0074	0.0099
Schistosoma mansoni	DNA topoisomerase II	0.0028	0.0196	0.0292
Mycobacterium leprae	PROBABLE NADH DEHYDROGENASE NDH	0.0085	0.0925	0.8717
Brugia malayi	hypothetical protein	0.0019	0.0074	0.0099
Schistosoma mansoni	hypothetical protein	0.0019	0.0074	0.0099
Echinococcus multilocularis	chromobox protein 1	0.0075	0.08	0.079
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0196	0.0292
Trypanosoma brucei	DNA polymerase eta, putative	0.0019	0.0075	0.0118
Mycobacterium ulcerans	two component system response phosphate sensor kinase, PhoR	0.0028	0.0196	0.2234
Brugia malayi	AMP-binding enzyme family protein	0.0021	0.0097	0.0137
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0073	0.0772	0.0762
Trichomonas vaginalis	chromobox protein, putative	0.0075	0.08	1
Toxoplasma gondii	exonuclease III APE	0.0036	0.029	0.0412
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0134	0.1557	0.2436
Mycobacterium tuberculosis	Probable sensor protein KdpD	0.0028	0.0196	0.0304
Trypanosoma cruzi	heat shock protein 85, putative	0.0028	0.0196	0.0193
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0031	0.0032
Echinococcus granulosus	lipoxygenase domain containing protein	0.0019	0.0074	0.0099
Echinococcus multilocularis	lipoxygenase domain containing protein	0.0019	0.0074	0.0063
Echinococcus multilocularis	geminin	0.0183	0.2184	0.2176
Brugia malayi	kinase, mitochondrial precursor	0.0508	0.636	1
Mycobacterium tuberculosis	Possible two component system response sensor kinase membrane associated PhoR	0.0028	0.0196	0.0304
Trypanosoma brucei	heat shock protein, putative	0.0028	0.0196	0.0309
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0075	0.0102
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0031	0.0032
Mycobacterium tuberculosis	Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.0015	0.0031	0.0019
Trypanosoma brucei	DNA topoisomerase ii	0.0028	0.0196	0.0309
Trypanosoma brucei	heat shock protein, putative	0.0028	0.0196	0.0309
Echinococcus multilocularis	DNA topoisomerase 2 alpha	0.0028	0.0196	0.0186
Mycobacterium tuberculosis	Probable NADH dehydrogenase Ndh	0.0085	0.0925	0.1558
Trypanosoma brucei	unspecified product	0.0019	0.0075	0.0118
Leishmania major	apurinic/apyrimidinic endonuclease-redox protein	0.0036	0.029	0.0342
Plasmodium vivax	thioredoxin reductase, putative	0.0037	0.0312	0.3794
Mycobacterium ulcerans	DNA gyrase subunit B	0.0028	0.0196	0.2234
Schistosoma mansoni	thyroid hormone receptor	0.0119	0.1363	0.213
Giardia lamblia	Pms1-like protein	0.0028	0.0196	0.563
Plasmodium falciparum	heat shock protein 90	0.0028	0.0196	0.5888
Leishmania major	4-coumarate:coa ligase-like protein	0.0021	0.0097	0.0036
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0134	0.1557	0.2436
Trichomonas vaginalis	ap endonuclease, putative	0.0036	0.029	0.2969
Loa Loa (eye worm)	hypothetical protein	0.0044	0.0394	0.0604
Mycobacterium ulcerans	putative regultory protein	0.0028	0.0196	0.2234
Leishmania major	hypothetical protein, conserved	0.0028	0.0196	0.0193
Echinococcus multilocularis	lipoxygenase domain containing protein	0.0019	0.0074	0.0063
Onchocerca volvulus		0.0033	0.0258	0.1214
Mycobacterium ulcerans	lipase LipD	0.0073	0.0772	1
Mycobacterium tuberculosis	Probable lipase LipE	0.0073	0.0772	0.1294
Giardia lamblia	Endonuclease/Exonuclease/phosphatase	0.0036	0.029	1
Schistosoma mansoni	hypothetical protein	0.0183	0.2184	0.3423
Leishmania major	heat shock protein 83-1	0.0028	0.0196	0.0193
Brugia malayi	ImpB/MucB/SamB family protein	0.0019	0.0075	0.0102
Trypanosoma cruzi	Present in the outer mitochondrial membrane proteome 4	0.0037	0.0309	0.0372
Echinococcus granulosus	DNA apurinic or apyrimidinic site lyase	0.0036	0.029	0.044
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0074	0.0099
Brugia malayi	DNA gyrase/topoisomerase IV, A subunit family protein	0.0028	0.0196	0.0292
Trichomonas vaginalis	ap endonuclease, putative	0.0036	0.029	0.2969
Echinococcus granulosus	terminal deoxycytidyl transferase rev1	0.0019	0.0075	0.0102
Entamoeba histolytica	exodeoxyribonuclease III, putative	0.0036	0.029	0.3656
Echinococcus granulosus	chromobox protein 1	0.0075	0.08	0.1243
Loa Loa (eye worm)	MH2 domain-containing protein	0.0108	0.1222	0.1907
Schistosoma mansoni	lipoxygenase	0.0019	0.0074	0.0099
Leishmania major	heat shock protein 83-1	0.0028	0.0196	0.0193
Mycobacterium tuberculosis	Conserved protein	0.0028	0.0196	0.0304
Echinococcus multilocularis	Mitotic checkpoint protein PRCC, C terminal	0.011	0.1249	0.124
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0074	0.0099
Mycobacterium ulcerans	fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE	0.0073	0.0772	1
Echinococcus multilocularis	chromobox protein 1	0.0075	0.08	0.079
Mycobacterium tuberculosis	Probable conserved lipoprotein	0.0073	0.0772	0.1294
Trypanosoma brucei	hypothetical protein, conserved	0.0073	0.0772	0.1214
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0075	0.0118
Mycobacterium leprae	conserved hypothetical protein	0.0073	0.0772	0.7104
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0466	0.5831	1
Plasmodium vivax	DNA topoisomerase II, putative	0.0028	0.0196	0.2234
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0134	0.1557	0.2436
Trichomonas vaginalis	conserved hypothetical protein	0.0042	0.0375	0.4138
Brugia malayi	DNA topoisomerase II, alpha isozyme	0.0028	0.0196	0.0292
Mycobacterium tuberculosis	Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed))	0.0019	0.0075	0.0095
Onchocerca volvulus	DNA topoisomerase 2 homolog	0.0028	0.0196	0.0808
Loa Loa (eye worm)	thioredoxin reductase	0.0037	0.0312	0.0475
Leishmania major	heat shock protein 83-1	0.0028	0.0196	0.0193
Plasmodium falciparum	glutathione reductase	0.0037	0.0312	1
Schistosoma mansoni	transcription factor LCR-F1	0.0065	0.0664	0.1028
Mycobacterium tuberculosis	Probable oxidoreductase	0.0094	0.1047	0.1768
Brugia malayi	Augmenter of liver regeneration	0.0037	0.0309	0.047
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	0.0036	0.029	0.044
Trypanosoma brucei	trypanothione reductase	0.0037	0.0312	0.049
Brugia malayi	beta-lactamase family protein	0.0073	0.0772	0.1199
Trypanosoma cruzi	developmentally regulated phosphoprotein, putative	0.0508	0.636	1
Echinococcus granulosus	RUN	0.0019	0.0074	0.0099
Brugia malayi	latrophilin 2 splice variant baaae	0.003	0.0216	0.0324
Leishmania major	heat shock protein 83-1	0.0028	0.0196	0.0193
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0075	0.0118
Echinococcus granulosus	FAD linked sulfhydryl oxidase ALR	0.0037	0.0309	0.047
Loa Loa (eye worm)	hypothetical protein	0.003	0.0216	0.0324
Trichomonas vaginalis	mismatch repair protein Mlh1C (mutL homolog)	0.0028	0.0196	0.1671
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0075	0.0118
Trypanosoma brucei	heat shock protein, putative	0.0028	0.0196	0.0309
Giardia lamblia	Heat shock protein HSP 90-alpha	0.0028	0.0196	0.563
Plasmodium falciparum	DNA gyrase subunit B	0.0028	0.0196	0.5888
Loa Loa (eye worm)	hypothetical protein	0.0508	0.636	1
Loa Loa (eye worm)	hypothetical protein	0.0073	0.0772	0.1199
Mycobacterium ulcerans	exodeoxyribonuclease III protein XthA	0.0036	0.029	0.3502
Trypanosoma brucei	heat shock protein, putative	0.0028	0.0196	0.0309
Loa Loa (eye worm)	heterochromatin protein 1	0.0075	0.08	0.1243
Mycobacterium tuberculosis	Possible two component sensor kinase TcrY	0.0028	0.0196	0.0304
Toxoplasma gondii	Erv1 / Alr family protein	0.0037	0.0309	0.0495
Mycobacterium leprae	PUTATIVE TWO COMPONENT SENSOR HISTIDINE KINASE SENX3	0.0028	0.0196	0.104
Mycobacterium ulcerans	beta-lactamase	0.0073	0.0772	1
Toxoplasma gondii	ATPase/histidine kinase/DNA gyrase B/HSP90 domain-containing protein	0.0206	0.2478	1
Echinococcus multilocularis	DNA (apurinic or apyrimidinic site) lyase	0.0036	0.029	0.028
Echinococcus multilocularis	terminal deoxycytidyl transferase rev1	0.0019	0.0075	0.0065
Chlamydia trachomatis	two component regulatory system sensor histidine kinase	0.0028	0.0196	1
Schistosoma mansoni	DNA polymerase eta	0.0019	0.0075	0.0102
Loa Loa (eye worm)	ImpB/MucB/SamB family protein	0.0019	0.0075	0.0102
Mycobacterium tuberculosis	Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI)	0.0036	0.029	0.0465
Leishmania major	heat shock protein 83-1	0.0028	0.0196	0.0193
Trypanosoma cruzi	heat shock protein 90, putative	0.0028	0.0196	0.0193
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0075	0.0118
Loa Loa (eye worm)	TOPoisomerase family member	0.0028	0.0196	0.0292
Trypanosoma cruzi	pyruvate dehydrogenase (lipoamide) kinase, putative	0.0177	0.2115	0.3246
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease	0.0036	0.029	0.0342
Brugia malayi	hypothetical protein	0.0137	0.1591	0.2488
Brugia malayi	Doublecortin family protein	0.0019	0.0074	0.0099
Schistosoma mansoni	rab geranylgeranyl transferase alpha subunit	0.0019	0.0075	0.0102
Mycobacterium leprae	Probable lipase LipE	0.0073	0.0772	0.7104
Echinococcus multilocularis	Polycystic kidney disease protein	0.0019	0.0074	0.0063
Trypanosoma cruzi	ERV/ALR sulfhydryl oxidase domain-containing protein	0.0037	0.0309	0.0372
Onchocerca volvulus		0.0073	0.0772	0.4603
Trypanosoma cruzi	heat shock protein 90, putative	0.0028	0.0196	0.0193
Echinococcus granulosus	Mitotic checkpoint protein PRCC C terminal	0.011	0.1249	0.1951
Trichomonas vaginalis	sensory transduction histidine kinase bacterial, putative	0.0028	0.0196	0.1671
Toxoplasma gondii	thioredoxin reductase	0.0037	0.0312	0.0507
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0075	0.0118
Echinococcus multilocularis	dna polymerase kappa	0.0019	0.0075	0.0065
Echinococcus multilocularis	dna polymerase eta	0.0019	0.0075	0.0065
Mycobacterium leprae	Probable two component sensor kinase MprB	0.0028	0.0196	0.104
Mycobacterium ulcerans	acyl-CoA synthetase	0.0021	0.0097	0.0901
Leishmania major	trypanothione reductase	0.0037	0.0312	0.0377
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0073	0.0772	0.1199
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0119	0.1363	0.1354
Mycobacterium leprae	DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE	0.0094	0.1047	1
Trichomonas vaginalis	receptor histidine kinase, putative	0.0028	0.0196	0.1671
Schistosoma mansoni	hypothetical protein	0.0183	0.2184	0.3423
Trichomonas vaginalis	two component sensor and regulator histidine kinase bacteria, putative	0.0028	0.0196	0.1671
Echinococcus granulosus	Polycystic kidney disease protein	0.0019	0.0074	0.0099
Mycobacterium tuberculosis	NAD(P)H quinone reductase LpdA	0.0094	0.1047	0.1768
Plasmodium vivax	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0036	0.029	0.3502
Brugia malayi	Cytochrome P450 family protein	0.002	0.0085	0.0118
Mycobacterium ulcerans	long-chain fatty-acid CoA ligase	0.0021	0.0097	0.0901
Mycobacterium tuberculosis	Possible conserved lipoprotein LpqK	0.0073	0.0772	0.1294
Leishmania major	heat shock protein 83-1	0.0028	0.0196	0.0193
Toxoplasma gondii	pyruvate dehydrogenase kinase, putative	0.0177	0.2115	0.8409
Onchocerca volvulus	Heterochromatin protein 1 homolog	0.0045	0.0416	0.2257
Brugia malayi	AMP-binding enzyme family protein	0.0021	0.0097	0.0137
Echinococcus granulosus	arachidonate 5 lipoxygenase	0.0052	0.0507	0.0781
Plasmodium vivax	FAD-linked sulfhydryl oxidase ERV1, putative	0.0037	0.0309	0.3756
Trypanosoma cruzi	trypanothione reductase, putative	0.0037	0.0312	0.0377
Echinococcus multilocularis	arachidonate 5 lipoxygenase	0.0052	0.0507	0.0497
Trichomonas vaginalis	sensor histidine kinase, putative	0.0028	0.0196	0.1671
Leishmania major	heat shock protein 83-1	0.0028	0.0196	0.0193
Mycobacterium tuberculosis	Conserved protein	0.0073	0.0772	0.1294
Loa Loa (eye worm)	beta-lactamase	0.0073	0.0772	0.1199
Echinococcus multilocularis	Pyruvate dehydrogenase (lipoamide) kinase	0.0508	0.636	0.6356
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0065	0.0664	0.1028
Onchocerca volvulus	DNA topoisomerase 2 homolog	0.0028	0.0196	0.0808
Trichomonas vaginalis	D-aminoacylase, putative	0.0073	0.0772	0.9617
Trypanosoma cruzi	mitochondrial DNA topoisomerase II, putative	0.0028	0.0196	0.0193
Trichomonas vaginalis	conserved hypothetical protein	0.003	0.0217	0.1955
Entamoeba histolytica	hypothetical protein	0.0065	0.0664	1
Mycobacterium ulcerans	long-chain-fatty-acid--CoA ligase	0.0021	0.0097	0.0901
Leishmania major	heat shock protein 83-1	0.0028	0.0196	0.0193
Mycobacterium tuberculosis	Two component sensor kinase [second part]	0.0028	0.0196	0.0304
Mycobacterium tuberculosis	Two component sensor histidine kinase PrrB	0.0028	0.0196	0.0304
Trypanosoma brucei	heat shock protein, putative	0.0028	0.0196	0.0309
Trypanosoma brucei	Histidine kinase-, DNA gyrase B-, and HSP90-like ATPase, putative	0.0028	0.0196	0.0309
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0258	0.039
Plasmodium falciparum	DNA topoisomerase VI, b subunit, putative	0.0028	0.0196	0.5888
Mycobacterium tuberculosis	Probable dehydrogenase	0.0085	0.0925	0.1558
Brugia malayi	hypothetical protein	0.0065	0.0664	0.1028
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0097	0.0137
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0134	0.1557	0.2436
Trypanosoma brucei	heat shock protein, putative	0.0028	0.0196	0.0309
Mycobacterium tuberculosis	Probable esterase/lipase LipP	0.0073	0.0772	0.1294
Mycobacterium leprae	TWO COMPONENT SENSOR HISTIDINE KINASE PRRB	0.0028	0.0196	0.104
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0021	0.0097	0.0379
Brugia malayi	ImpB/MucB/SamB family protein	0.0019	0.0075	0.0102
Mycobacterium tuberculosis	NADPH-dependent mycothiol reductase Mtr	0.0037	0.0312	0.0503
Mycobacterium tuberculosis	Probable two component sensor kinase	0.0028	0.0196	0.0304
Plasmodium vivax	multidomain scavenger receptor, putative	0.0019	0.0074	0.0581
Brugia malayi	Endoplasmin precursor	0.0028	0.0196	0.0292
Leishmania major	heat shock protein 83-1	0.0028	0.0196	0.0193
Echinococcus granulosus	heat shock protein 90	0.0028	0.0196	0.0292
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0073	0.0772	0.1199
Mycobacterium ulcerans	two component sensor histidine kinase SenX3	0.0028	0.0196	0.2234
Trypanosoma brucei	heat shock protein 90, putative	0.0028	0.0196	0.0309
Schistosoma mansoni	pyruvate dehydrogenase	0.0479	0.5997	0.9428
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease, putative	0.0036	0.029	0.0342
Mycobacterium tuberculosis	Probable membrane NADH dehydrogenase NdhA	0.0085	0.0925	0.1558
Leishmania major	4-coumarate:coa ligase-like protein	0.0021	0.0097	0.0036
Trichomonas vaginalis	heat shock protein, putative	0.0028	0.0196	0.1671
Mycobacterium leprae	Probable two-component sensor kinase	0.0028	0.0196	0.104
Brugia malayi	exodeoxyribonuclease III family protein	0.0036	0.029	0.044
Entamoeba histolytica	DNA topoisomerase II, putative	0.0028	0.0196	0.2058
Treponema pallidum	exodeoxyribonuclease (exoA)	0.0036	0.029	1
Schistosoma mansoni	hypothetical protein	0.011	0.1249	0.1951
Mycobacterium ulcerans	esterase/lipase LipP	0.0073	0.0772	1
Brugia malayi	MH2 domain containing protein	0.0108	0.1222	0.1907
Schistosoma mansoni	ap endonuclease	0.0036	0.029	0.044
Brugia malayi	hypothetical protein	0.0019	0.0074	0.0099
Mycobacterium ulcerans	two component sensory transduction histidine kinase MtrB	0.0028	0.0196	0.2234
Leishmania major	mitochondrial DNA topoisomerase II	0.0028	0.0196	0.0193
Brugia malayi	beta-lactamase family protein	0.0073	0.0772	0.1199
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0044	0.0394	0.0604
Schistosoma mansoni	lipoxygenase	0.0052	0.0507	0.0781
Trichomonas vaginalis	heat shock protein, putative	0.0028	0.0196	0.1671
Plasmodium vivax	heat shock protein 86, putative	0.0028	0.0196	0.2234
Trypanosoma brucei	developmentally regulated phosphoprotein	0.0508	0.636	1
Echinococcus granulosus	Pyruvate dehydrogenase lipoamide kinase	0.0508	0.636	1
Schistosoma mansoni	chromobox protein	0.0075	0.08	0.1243

Activities

Activity type	Activity value	Assay description	Source	Reference
T1/2 (ADMET)	= 62 min	Half life in human blood assessed as 3-((2-(bis(2-chloroethyl)amino)ethoxy)carbonyl)-1-phenylpyridinium iodide level at 250 ug/ml by UV-spectrophotometric analysis	ChEMBL.	No reference

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: CHEMBL2425241

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1789421