TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 768.128 | Formula: C40H81N9O5
H donors: 7 H acceptors: 5 LogP: 3.25 Rotable bonds: 42
Rule of 5 violations (Lipinski): 3
SMILES: NCCCC[C@@H](CN(C(=O)CCCN)CC(=O)N[C@H](CN(C(=O)CCCN)CC(=O)N)CCCCN)NC(=O)CCCCCCCCCCCCCCC
InChi: 1S/C40H81N9O5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-23-37(51)46-34(21-15-17-26-41)31-49(40(54)25-20-29-44)33-38(52)47-35(22-16-18-27-42)30-48(32-36(45)50)39(53)24-19-28-43/h34-35H,2-33,41-44H2,1H3,(H2,45,50)(H,46,51)(H,47,52)/t34-,35-/m0/s1
InChiKey: OQLHDYCDBVMHJV-PXLJZGITSA-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	chromodomain helicase DNA binding protein, putative	0.0007	0.0006	0.0025
Trypanosoma brucei	DNA topoisomerase II alpha, putative	0.0305	0.1597	0.2769
Schistosoma mansoni	ran	0.0022	0.0086	0.037
Trypanosoma brucei	heat shock protein, putative	0.0059	0.0285	0.0494
Trypanosoma brucei	Histidine kinase-, DNA gyrase B-, and HSP90-like ATPase, putative	0.0059	0.0285	0.0494
Trypanosoma brucei	heat shock protein, putative	0.0059	0.0285	0.0494
Plasmodium falciparum	DNA topoisomerase 3, putative	0.0134	0.0687	0.0687
Trichomonas vaginalis	prokaryotic DNA topoisomerase, putative	0.0134	0.0687	0.297
Plasmodium falciparum	endoplasmin, putative	0.0059	0.0285	0.0285
Trichomonas vaginalis	penicillin-binding protein, putative	0.0037	0.0166	0.0717
Toxoplasma gondii	ABC1 family protein	0.0037	0.0166	0.0288
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0166	0.0717
Chlamydia trachomatis	DNA gyrase subunit B	0.1232	0.6547	0.6446
Trichomonas vaginalis	DNA topoisomerase II, putative	0.0439	0.2314	1
Trichomonas vaginalis	esterase, putative	0.0037	0.0166	0.0717
Brugia malayi	CXXC zinc finger family protein	0.0029	0.0126	0.0546
Loa Loa (eye worm)	DNA topoisomerase III beta-1	0.0134	0.0687	0.297
Echinococcus granulosus	DNA topoisomerase 3 alpha	0.0134	0.0687	0.297
Trypanosoma cruzi	developmentally regulated phosphoprotein, putative	0.0059	0.0285	0.0351
Brugia malayi	F/Y-rich N-terminus family protein	0.0009	0.0018	0.0078
Mycobacterium ulcerans	two component sensor histidine kinase DevS	0.0059	0.0285	0.0121
Schistosoma mansoni	importin beta-1	0.0029	0.0127	0.0549
Echinococcus granulosus	snurportin 1	0.0313	0.1643	0.7098
Trypanosoma brucei	Heat shock protein 83, putative	0.0059	0.0285	0.0494
Mycobacterium leprae	Probable two-component sensor kinase	0.0059	0.0285	0.0366
Brugia malayi	DNA topoisomerase II, alpha isozyme	0.0439	0.2314	1
Echinococcus multilocularis	heat shock protein 90	0.0059	0.0285	0.1232
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0007	0.0006	0.0025
Trypanosoma cruzi	DNA topoisomerase II, putative	0.0305	0.1597	0.266
Trypanosoma brucei	heat shock protein, putative	0.0059	0.0285	0.0494
Plasmodium falciparum	DNA topoisomerase VI, b subunit, putative	0.0059	0.0285	0.0285
Toxoplasma gondii	heat shock protein HSP90	0.0059	0.0285	0.0494
Schistosoma mansoni	ran	0.0022	0.0086	0.037
Trichomonas vaginalis	sensory transduction histidine kinase bacterial, putative	0.0059	0.0285	0.1232
Onchocerca volvulus		0.0134	0.0687	0.2564
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0029	0.0126	0.0546
Plasmodium falciparum	GTP-binding nuclear protein RAN/TC4	0.0022	0.0086	0.0086
Mycobacterium tuberculosis	Two component sensor histidine kinase DevS	0.0059	0.0285	0.0121
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0166	0.0717
Brugia malayi	Endoplasmin precursor	0.0059	0.0285	0.1232
Leishmania major	heat shock protein 83-1	0.0059	0.0285	0.0494
Schistosoma mansoni	prokaryotic DNA topoisomerase	0.0134	0.0687	0.297
Trichomonas vaginalis	heat shock protein, putative	0.0059	0.0285	0.1232
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0037	0.0166	0.0717
Trypanosoma brucei	heat shock protein 90, putative	0.0059	0.0285	0.0494
Trichomonas vaginalis	importin beta-1, putative	0.0024	0.0097	0.0421
Schistosoma mansoni	endoplasmin	0.0059	0.0285	0.1232
Leishmania major	DNA topoisomerase 1A	0.0134	0.0687	0.1192
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0062	0.0301	0.1302
Echinococcus granulosus	Pyruvate dehydrogenase lipoamide kinase	0.0059	0.0285	0.1232
Brugia malayi	Importin beta-1 subunit	0.0029	0.0127	0.0549
Trichomonas vaginalis	endoplasmin, putative	0.0059	0.0285	0.1232
Mycobacterium tuberculosis	Possible two component sensor kinase TcrY	0.0059	0.0285	0.0121
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0055	0.0266	0.0461
Trypanosoma cruzi	DNA topoisomerase III, putative	0.0134	0.0687	0.1059
Schistosoma mansoni	DNA topoisomerase II	0.0439	0.2314	1
Onchocerca volvulus		0.0037	0.0166	0.0181
Mycobacterium tuberculosis	Two component sensor kinase [second part]	0.0059	0.0285	0.0121
Echinococcus multilocularis	rho GTPase activating protein 20	0.0134	0.0687	0.297
Leishmania major	heat shock protein 83-1	0.0059	0.0285	0.0494
Mycobacterium tuberculosis	Two component sensor histidine kinase TrcS	0.0059	0.0285	0.0121
Mycobacterium ulcerans	DNA topoisomerase I	0.0134	0.0687	0.053
Brugia malayi	GTP-binding nuclear protein RAN/TC4	0.0022	0.0086	0.037
Leishmania major	heat shock protein 83-1	0.0059	0.0285	0.0494
Echinococcus granulosus	heat shock protein	0.0059	0.0285	0.1232
Echinococcus multilocularis	importin subunit beta 1	0.0029	0.0127	0.0549
Trypanosoma cruzi	heat shock protein 85, putative	0.0059	0.0285	0.0351
Entamoeba histolytica	DNA topoisomerase II, putative	0.0439	0.2314	1
Plasmodium vivax	GTP-binding nuclear protein RAN/TC4, putative	0.0022	0.0086	0.0086
Trichomonas vaginalis	ran, putative	0.0022	0.0086	0.037
Trypanosoma cruzi	hypothetical protein, conserved	0.0037	0.0166	0.0141
Mycobacterium tuberculosis	Two component sensory transduction histidine kinase MtrB	0.0059	0.0285	0.0121
Plasmodium falciparum	importin beta, putative	0.0029	0.0127	0.0127
Leishmania major	importin beta-1 subunit, putative	0.0024	0.0097	0.0169
Trichomonas vaginalis	penicillin-binding protein, putative	0.0037	0.0166	0.0717
Leishmania major	heat shock protein 83-1	0.0059	0.0285	0.0494
Mycobacterium ulcerans	putative regultory protein	0.0059	0.0285	0.0121
Giardia lamblia	Pms1-like protein	0.0059	0.0285	0.1042
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0.0006	0.0025
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0007	0.0009	0.0039
Loa Loa (eye worm)	histone methyltransferase	0.0009	0.0019	0.0081
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0007	0.0006	0.0025
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0166	0.0717
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0009	0.0019	0.0081
Treponema pallidum	DNA gyrase, subunit B (gyrB)	0.1879	1	1
Trypanosoma brucei	DNA topoisomerase III, putative	0.0134	0.0687	0.1192
Trypanosoma brucei	DNA topoisomerase ii	0.1086	0.5767	1
Echinococcus multilocularis	GTP binding nuclear protein Ran	0.0022	0.0086	0.037
Plasmodium vivax	DNA gyrase subunit B, putative	0.1879	1	1
Onchocerca volvulus	Putative DNA topoisomerase 2, mitochondrial	0.0439	0.2314	1
Trypanosoma cruzi	Heat shock protein 83, putative	0.0059	0.0285	0.0351
Trypanosoma brucei	importin beta-1 subunit, putative	0.0029	0.0127	0.022
Entamoeba histolytica	hypothetical protein	0.0024	0.0097	0.0421
Toxoplasma gondii	ATPase/histidine kinase/DNA gyrase B/HSP90 domain-containing protein	0.1086	0.5767	1
Trypanosoma brucei	heat shock protein, putative	0.0059	0.0285	0.0494
Trichomonas vaginalis	sensory transduction histidine kinase bacterial, putative	0.0059	0.0285	0.1232
Echinococcus granulosus	cpg binding protein	0.0031	0.0135	0.0585
Entamoeba histolytica	heat shock protein 90, putative	0.0059	0.0285	0.1232
Brugia malayi	DNA topoisomerase III beta-1	0.0134	0.0687	0.297
Wolbachia endosymbiont of Brugia malayi	DNA gyrase, topoisomerase II, B subunit, GyrB	0.1879	1	1
Loa Loa (eye worm)	nucleolar RNA-associated protein alpha	0.0313	0.1643	0.7098
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0234	0.122	0.1072
Plasmodium falciparum	DNA gyrase subunit B	0.1879	1	1
Brugia malayi	Probable DNA topoisomerase II	0.0439	0.2314	1
Schistosoma mansoni	hypothetical protein	0.0313	0.1643	0.7098
Echinococcus granulosus	dnaJ subfamily B	0.0416	0.2193	0.9474
Leishmania major	heat shock protein 83-1	0.0059	0.0285	0.0494
Schistosoma mansoni	hypothetical protein	0.0416	0.2193	0.9474
Mycobacterium leprae	PUTATIVE TWO COMPONENT SENSOR HISTIDINE KINASE SENX3	0.0059	0.0285	0.0366
Echinococcus granulosus	beta LACTamase domain containing family member	0.0037	0.0166	0.0717
Schistosoma mansoni	endoplasmin	0.0059	0.0285	0.1232
Mycobacterium tuberculosis	Probable sensor protein KdpD	0.0059	0.0285	0.0121
Trichomonas vaginalis	Importin beta-1 subunit, putative	0.0024	0.0097	0.0421
Trichomonas vaginalis	D-aminoacylase, putative	0.0037	0.0166	0.0717
Loa Loa (eye worm)	GTP-binding nuclear protein RAN/TC4	0.0022	0.0086	0.037
Echinococcus multilocularis	snurportin 1	0.0313	0.1643	0.7098
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.0007	0.0006	0.0025
Trypanosoma brucei	heat shock protein, putative	0.0059	0.0285	0.0494
Trypanosoma cruzi	heat shock protein 85, putative	0.0059	0.0285	0.0351
Trypanosoma brucei	importin beta-1 subunit, putative	0.0029	0.0127	0.022
Toxoplasma gondii	HEAT repeat-containing protein	0.0029	0.0127	0.022
Mycobacterium tuberculosis	DNA gyrase (subunit B) GyrB (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (type II DNA topoisomerase)	0.1879	1	1
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0.0006	0.0025
Treponema pallidum	DNA topoisomerase I (topA)	0.0134	0.0687	0.0414
Mycobacterium leprae	Probable DNA topoisomerase I TopA (omega-protein) (relaxing enzyme) (untwisting enzyme) (swivelase) (type I DNA topoisomerase) (	0.0134	0.0687	0.1601
Brugia malayi	GRF zinc finger family protein	0.0134	0.0687	0.297
Trichomonas vaginalis	mismatch repair protein Mlh1C (mutL homolog)	0.0059	0.0285	0.1232
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0007	0.0009	0.0039
Plasmodium vivax	DNA topoisomerase 3, putative	0.0134	0.0687	0.0687
Leishmania major	heat shock protein 83-1	0.0059	0.0285	0.0494
Brugia malayi	kinase, mitochondrial precursor	0.0059	0.0285	0.1232
Onchocerca volvulus	DNA topoisomerase 2 homolog	0.0439	0.2314	1
Brugia malayi	beta-lactamase	0.0037	0.0166	0.0717
Brugia malayi	DNA topoisomerase III	0.0134	0.0687	0.297
Leishmania major	heat shock protein 83-1	0.0059	0.0285	0.0494
Leishmania major	DNA topoisomerase ii	0.0305	0.1597	0.2769
Plasmodium falciparum	DNA topoisomerase 2	0.0439	0.2314	0.2314
Trichomonas vaginalis	D-aminoacylase, putative	0.0037	0.0166	0.0717
Loa Loa (eye worm)	hypothetical protein	0.0305	0.1597	0.6902
Toxoplasma gondii	DNA topoisomerase family protein	0.0134	0.0687	0.1192
Entamoeba histolytica	DNA topoisomerase III, putative	0.0134	0.0687	0.297
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0.0006	0.0025
Leishmania major	heat shock protein 83-1	0.0059	0.0285	0.0494
Giardia lamblia	DNA topoisomerase III	0.0134	0.0687	0.3144
Toxoplasma gondii	heat shock protein 90, putative	0.0059	0.0285	0.0494
Leishmania major	heat shock protein 83-1	0.0059	0.0285	0.0494
Leishmania major	heat shock protein 83-1	0.0059	0.0285	0.0494
Trypanosoma brucei	heat shock protein, putative	0.0059	0.0285	0.0494
Echinococcus granulosus	mixed lineage leukemia protein mll	0.0007	0.0009	0.0039
Schistosoma mansoni	cpg binding protein	0.0031	0.0135	0.0585
Trypanosoma brucei	heat shock protein, putative	0.0059	0.0285	0.0494
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0166	0.0717
Wolbachia endosymbiont of Brugia malayi	topoisomerase IA, TopA	0.0134	0.0687	0.0414
Onchocerca volvulus		0.0037	0.0166	0.0181
Trypanosoma brucei	heat shock protein 90, putative	0.0059	0.0285	0.0494
Trypanosoma brucei	hypothetical protein, conserved	0.0037	0.0166	0.0288
Loa Loa (eye worm)	DNA topoisomerase III	0.0134	0.0687	0.297
Trichomonas vaginalis	D-aminoacylase, putative	0.0037	0.0166	0.0717
Chlamydia trachomatis	DNA topoisomerase I	0.0134	0.0687	0.0414
Leishmania major	heat shock protein 83-1	0.0059	0.0285	0.0494
Echinococcus granulosus	GTP binding nuclear protein Ran	0.0022	0.0086	0.037
Trypanosoma cruzi	DNA topoisomerase III, putative	0.0134	0.0687	0.1059
Echinococcus multilocularis	dnaJ subfamily B	0.0416	0.2193	0.9474
Trypanosoma cruzi	heat shock protein 85, putative	0.0059	0.0285	0.0351
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0037	0.0166	0.0717
Mycobacterium ulcerans	two component sensory transduction histidine kinase MtrB	0.0059	0.0285	0.0121
Trypanosoma cruzi	DNA topoisomerase III, putative	0.0134	0.0687	0.1059
Mycobacterium ulcerans	two component sensor kinase MprB	0.0059	0.0285	0.0121
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0009	0.0019	0.0081
Leishmania major	hypothetical protein, conserved	0.0059	0.0285	0.0494
Mycobacterium tuberculosis	Probable two component sensor kinase	0.0059	0.0285	0.0121
Leishmania major	DNA topoisomerase III, putative	0.0134	0.0687	0.1192
Trichomonas vaginalis	Importin beta-1 subunit, putative	0.0024	0.0097	0.0421
Entamoeba histolytica	heat shock protein 90, putative	0.0059	0.0285	0.1232
Brugia malayi	beta-lactamase family protein	0.0037	0.0166	0.0717
Leishmania major	heat shock protein 83-1	0.0059	0.0285	0.0494
Mycobacterium tuberculosis	Two component sensor histidine kinase PrrB	0.0059	0.0285	0.0121
Loa Loa (eye worm)	heat shock protein 90	0.0059	0.0285	0.1232
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0.0006	0.0025
Trypanosoma brucei	DNA topoisomerase IA, putative	0.0134	0.0687	0.1192
Schistosoma mansoni	heat shock protein	0.0059	0.0285	0.1232
Mycobacterium tuberculosis	Two component sensor kinase MprB	0.0059	0.0285	0.0121
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0037	0.0166	0.0717
Trypanosoma cruzi	importin beta-1 subunit, putative	0.0024	0.0097	0.0021
Mycobacterium tuberculosis	Possible two component sensor kinase	0.0059	0.0285	0.0121
Echinococcus granulosus	DNA topoisomerase 2 alpha	0.0439	0.2314	1
Echinococcus granulosus	heat shock protein 90	0.0059	0.0285	0.1232
Toxoplasma gondii	DNA topoisomerase 2, putative	0.0439	0.2314	0.4013
Loa Loa (eye worm)	endoplasmin	0.0059	0.0285	0.1232
Giardia lamblia	DNA topoisomerase II	0.038	0.2	1
Trypanosoma brucei	GTP-binding nuclear protein rtb2, putative	0.0022	0.0086	0.0149
Echinococcus multilocularis	DNA topoisomerase 3 beta 1	0.0134	0.0687	0.297
Trypanosoma cruzi	mitochondrial DNA topoisomerase II, putative	0.1086	0.5767	1
Plasmodium vivax	hypothetical protein, conserved	0.0059	0.0285	0.0285
Plasmodium falciparum	heat shock protein 90	0.0059	0.0285	0.0285
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0007	0.0006	0.0025
Loa Loa (eye worm)	hypothetical protein	0.0059	0.0285	0.1232
Loa Loa (eye worm)	hypothetical protein	0.0305	0.1597	0.6902
Trypanosoma cruzi	Histidine kinase-, DNA gyrase B-, and HSP90-like ATPase, putative	0.0059	0.0285	0.0351
Mycobacterium leprae	Probable DNA gyrase (subunit B) GyrB (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (Type II DNA topoisomerase)	0.0647	0.3423	1
Trichomonas vaginalis	receptor histidine kinase, putative	0.0059	0.0285	0.1232
Schistosoma mansoni	pyruvate dehydrogenase	0.0059	0.0285	0.1232
Mycobacterium leprae	TWO COMPONENT SENSOR HISTIDINE KINASE PRRB	0.0059	0.0285	0.0366
Schistosoma mansoni	cpg binding protein	0.0029	0.0126	0.0546
Mycobacterium leprae	Probable two component sensor kinase MprB	0.0059	0.0285	0.0366
Trichomonas vaginalis	receptor histidine kinase, putative	0.0059	0.0285	0.1232
Trypanosoma cruzi	mitochondrial DNA topoisomerase II, putative	0.1086	0.5767	1
Leishmania major	GTP-binding protein, putative	0.0022	0.0086	0.0149
Plasmodium vivax	heat shock protein 86, putative	0.0059	0.0285	0.0285
Mycobacterium ulcerans	two component sensor histidine kinase TrcS	0.0059	0.0285	0.0121
Trypanosoma cruzi	heat shock protein 90, putative	0.0059	0.0285	0.0351
Trypanosoma brucei	developmentally regulated phosphoprotein	0.0059	0.0285	0.0494
Giardia lamblia	Heat shock protein HSP 90-alpha	0.0059	0.0285	0.1042
Mycobacterium ulcerans	two component sensor histidine kinase SenX3	0.0059	0.0285	0.0121
Trypanosoma cruzi	DNA topoisomerase II, putative	0.0305	0.1597	0.266
Trypanosoma brucei	DNA topoisomerase III, putative	0.0134	0.0687	0.1192
Trichomonas vaginalis	heat shock protein, putative	0.0059	0.0285	0.1232
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.0007	0.0006	0.0025
Onchocerca volvulus	DNA topoisomerase 2 homolog	0.0439	0.2314	1
Echinococcus multilocularis	DNA topoisomerase 2 alpha	0.0439	0.2314	1
Plasmodium vivax	importin-beta 2, putative	0.0029	0.0127	0.0127
Leishmania major	mitochondrial DNA topoisomerase II	0.1086	0.5767	1
Mycobacterium ulcerans	two component regulator - sensor kinase	0.0059	0.0285	0.0121
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0037	0.0166	0.0717
Trichomonas vaginalis	helicase, putative	0.0007	0.0006	0.0025
Echinococcus multilocularis	Pyruvate dehydrogenase (lipoamide) kinase	0.0059	0.0285	0.1232
Plasmodium vivax	DNA topoisomerase II, putative	0.0439	0.2314	0.2314
Mycobacterium tuberculosis	Possible two component system response sensor kinase membrane associated PhoR	0.0059	0.0285	0.0121
Trichomonas vaginalis	prokaryotic DNA topoisomerase, putative	0.0134	0.0687	0.297
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0166	0.0717
Leishmania major	heat shock protein 83-1	0.0059	0.0285	0.0494
Leishmania major	heat shock protein 83-1	0.0059	0.0285	0.0494
Schistosoma mansoni	heat shock protein	0.0059	0.0285	0.1232
Plasmodium vivax	hypothetical protein, conserved	0.0037	0.0166	0.0166
Onchocerca volvulus		0.0037	0.0166	0.0181
Mycobacterium ulcerans	two component system membrane associated sensor kinase	0.0059	0.0285	0.0121
Brugia malayi	heat shock protein 90	0.0059	0.0285	0.1232
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0007	0.0006	0.0025
Trypanosoma cruzi	heat shock protein 90, putative	0.0059	0.0285	0.0351
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0166	0.0717
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0.0006	0.0025
Echinococcus multilocularis	mixed lineage leukemia protein mll	0.0007	0.0009	0.0039
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0037	0.0166	0.0717
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0007	0.0006	0.0025
Mycobacterium ulcerans	two component sensor histidine kinase PrrB	0.0059	0.0285	0.0121
Mycobacterium tuberculosis	Conserved protein	0.0059	0.0285	0.0121
Giardia lamblia	DNA topoisomerase III	0.0134	0.0687	0.3144
Plasmodium vivax	endoplasmin, putative	0.0059	0.0285	0.0285
Entamoeba histolytica	Ran family GTPase	0.0022	0.0086	0.037
Mycobacterium tuberculosis	Two component sensor histidine kinase DosT	0.0059	0.0285	0.0121
Leishmania major	heat shock protein 83-1	0.0059	0.0285	0.0494
Trypanosoma brucei	heat shock protein, putative	0.0059	0.0285	0.0494
Echinococcus granulosus	DNA topoisomerase 3 beta 1	0.0134	0.0687	0.297
Brugia malayi	RNA, U transporter 1	0.0083	0.0416	0.1797
Mycobacterium ulcerans	sensor kinase from two component regulatory system	0.0059	0.0285	0.0121
Echinococcus multilocularis	cpg binding protein	0.0031	0.0135	0.0585
Mycobacterium ulcerans	two component system response phosphate sensor kinase, PhoR	0.0059	0.0285	0.0121
Trypanosoma cruzi	DNA topoisomerase IA, putative	0.0134	0.0687	0.1059
Toxoplasma gondii	ATPase/histidine kinase/DNA gyrase B/HSP90 domain-containing protein	0.0059	0.0285	0.0494
Trypanosoma brucei	DNA topoisomerase II beta, putative	0.0305	0.1597	0.2769
Leishmania major	hypothetical protein, conserved	0.0037	0.0166	0.0288
Trypanosoma cruzi	hypothetical protein, conserved	0.0037	0.0166	0.0141
Trichomonas vaginalis	sensor histidine kinase, putative	0.0059	0.0285	0.1232
Trichomonas vaginalis	two component sensor and regulator histidine kinase bacteria, putative	0.0059	0.0285	0.1232
Leishmania major	heat shock protein 83-1	0.0059	0.0285	0.0494
Trypanosoma cruzi	DNA topoisomerase IA, putative	0.0134	0.0687	0.1059
Echinococcus granulosus	importin subunit beta 1	0.0029	0.0127	0.0549
Schistosoma mansoni	prokaryotic DNA topoisomerase	0.0134	0.0687	0.297
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0127	0.0549
Echinococcus multilocularis	Pyruvate dehydrogenase (lipoamide) kinase	0.0059	0.0285	0.1232
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0.0006	0.0025
Toxoplasma gondii	ATPase/histidine kinase/DNA gyrase B/HSP90 domain-containing protein	0.0059	0.0285	0.0494
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0.0006	0.0025
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0007	0.0009	0.0039
Leishmania major	heat shock protein 83-1	0.0059	0.0285	0.0494
Trichomonas vaginalis	sensory transduction histidine kinase, putative	0.0059	0.0285	0.1232
Echinococcus multilocularis	heat shock protein	0.0059	0.0285	0.1232
Loa Loa (eye worm)	beta-lactamase	0.0037	0.0166	0.0717
Toxoplasma gondii	DNA topoisomerase domain-containing protein	0.0134	0.0687	0.1192
Loa Loa (eye worm)	TOPoisomerase family member	0.0439	0.2314	1
Leishmania major	DNA topoisomerase III, putative	0.0134	0.0687	0.1192
Entamoeba histolytica	DNA topoisomerase III, putative	0.0134	0.0687	0.297
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0.0006	0.0025
Schistosoma mansoni	cpg binding protein	0.0031	0.0135	0.0585
Brugia malayi	DNA gyrase/topoisomerase IV, A subunit family protein	0.0439	0.2314	1
Brugia malayi	beta-lactamase family protein	0.0037	0.0166	0.0717
Trichomonas vaginalis	conserved hypothetical protein	0.0007	0.0006	0.0025
Leishmania major	developmentally regulated phosphoprotein-like protein	0.0059	0.0285	0.0494
Mycobacterium ulcerans	DNA gyrase subunit B	0.1879	1	1
Toxoplasma gondii	GTP-binding nuclear protein ran/tc4	0.0022	0.0086	0.0149

Activities

Activity type	Activity value	Assay description	Source	Reference
MIC (functional)	= 2 ug ml-1	Antifungal activity against Candida albicans ATCC 10231 after 48 hrs by broth micro-dilution method	ChEMBL.	22475244
MIC (functional)	= 30 ug ml-1	Antibacterial activity against Escherichia coli JM109 after 24 hrs by broth micro-dilution method	ChEMBL.	22475244

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: CHEMBL2047005

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1654641