TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 332.14 | Formula: C17H21ClN4O
H donors: 1 H acceptors: 2 LogP: 2.84 Rotable bonds: 4
Rule of 5 violations (Lipinski): 0
SMILES: CC(NC(=O)N1CCN(CC1)c1ccnc2c1ccc(c2)Cl)C
InChi: InChI=1S/C17H21ClN4O/c1-12(2)20-17(23)22-9-7-21(8-10-22)16-5-6-19-15-11-13(18)3-4-14(15)16/h3-6,11-12H,7-10H2,1-2H3,(H,20,23)
InChiKey: KABWLRIZBIWIEQ-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 multilocularis	ATP binding cassette subfamily B (MDR:TAP)	0.0625	0.8425	0.8425
Brugia malayi	hypothetical protein	0.0137	0.1688	0.1688
Brugia malayi	ABC transporter	0.0199	0.2537	0.2537
Leishmania major	ATP-binding cassette protein subfamily C, member 2, putative	0.0199	0.2537	0.2994
Schistosoma mansoni	smdr2	0.0625	0.8425	0.8425
Brugia malayi	hypothetical protein	0.0089	0.1015	0.1015
Trypanosoma cruzi	ABC transporter of the mitochondrion, putative	0.0199	0.2537	0.4561
Entamoeba histolytica	ATP-binding cassette protein, putative	0.0199	0.2537	0.2671
Loa Loa (eye worm)	ABC transporter	0.0199	0.2537	0.2537
Loa Loa (eye worm)	hypothetical protein	0.0062	0.0649	0.0649
Echinococcus multilocularis	ATP binding cassette sub family B	0.0199	0.2537	0.2537
Plasmodium falciparum	ataxin-2 like protein, putative	0.0137	0.1688	0.1984
Loa Loa (eye worm)	hypothetical protein	0.0187	0.2377	0.2377
Trypanosoma cruzi	multidrug resistance-associated protein, putative	0.0199	0.2537	0.4561
Schistosoma mansoni	ATP-binding cassette sub-family g2 (white protein) (abcg2)	0.0416	0.5538	0.5538
Mycobacterium tuberculosis	Probable drugs-transport transmembrane ATP-binding protein ABC transporter	0.0199	0.2537	0.2994
Plasmodium vivax	multidrug resistance-associated protein 2, putative	0.0199	0.2537	0.2994
Trichomonas vaginalis	abcb9, putative	0.0625	0.8425	1
Schistosoma mansoni	multidrug resistance protein	0.0199	0.2537	0.2537
Entamoeba histolytica	P-glycoprotein 6, putative	0.0199	0.2537	0.2671
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0196	0.25	0.25
Mycobacterium ulcerans	transmembrane ABC transporter ATP-binding protein	0.0416	0.5538	1
Trichomonas vaginalis	lipid A export ATP-binding/permease protein msba, putative	0.0625	0.8425	1
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0017	0.0021	0.0021
Schistosoma mansoni	hypothetical protein	0.0342	0.4519	0.4519
Entamoeba histolytica	P-glycoprotein-1	0.0625	0.8425	1
Trichomonas vaginalis	ABC transporter, half transporter, putative	0.0625	0.8425	1
Schistosoma mansoni	hypothetical protein	0.0205	0.2619	0.2619
Echinococcus multilocularis	Smad4	0.0034	0.026	0.026
Toxoplasma gondii	ABC transporter family protein	0.0199	0.2537	0.2994
Schistosoma mansoni	hypothetical protein	0.0084	0.0951	0.0951
Chlamydia trachomatis	ABC transporter ATP binding protein/permease	0.0625	0.8425	0.5
Schistosoma mansoni	hypothetical protein	0.0205	0.2619	0.2619
Loa Loa (eye worm)	MH2 domain-containing protein	0.0034	0.026	0.026
Toxoplasma gondii	ATP-binding cassette G family transporter ABCG87	0.0074	0.0809	0.0938
Entamoeba histolytica	ATP-binding cassette protein, putative	0.0199	0.2537	0.2671
Brugia malayi	Pax transcription factor protein 2	0.0254	0.3303	0.3303
Brugia malayi	RE11181p	0.0062	0.0649	0.0649
Schistosoma mansoni	multidrug resistance protein	0.0625	0.8425	0.8425
Giardia lamblia	Multidrug resistance-associated protein 1	0.0199	0.2537	0.0532
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0017	0.0021	0.0021
Brugia malayi	Isocitrate dehydrogenase	0.0017	0.0021	0.0021
Brugia malayi	multidrug resistance related protein 1	0.0199	0.2537	0.2537
Trichomonas vaginalis	multidrug resistance protein 1, 2, putative	0.0625	0.8425	1
Toxoplasma gondii	ATP-binding cassette G family transporter ABCG107	0.0074	0.0809	0.0938
Echinococcus granulosus	multidrug resistance protein 1	0.0625	0.8425	0.8425
Schistosoma mansoni	smad	0.0034	0.026	0.026
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0043	0.0391	0.0391
Trypanosoma brucei	PAB1-binding protein , putative	0.0137	0.1688	0.3023
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0084	0.0951	0.0951
Echinococcus granulosus	geminin	0.0205	0.2619	0.2619
Schistosoma mansoni	hypothetical protein	0.0043	0.0391	0.0391
Trypanosoma cruzi	ABC transporter, putative	0.0062	0.0649	0.114
Brugia malayi	ABC transporter family protein	0.0625	0.8425	0.8425
Brugia malayi	ABC transporter transmembrane region family protein	0.0187	0.2377	0.2377
Trichomonas vaginalis	multidrug resistance protein 1, 2, putative	0.0625	0.8425	1
Brugia malayi	hypothetical protein	0.016	0.1996	0.1996
Entamoeba histolytica	P-glycoprotein-2, putative	0.0625	0.8425	1
Loa Loa (eye worm)	ATP-binding cassette sub-family B member 2	0.0625	0.8425	0.8425
Plasmodium falciparum	ABC transporter B family member 4, putative	0.0199	0.2537	0.2994
Trypanosoma brucei	p-glycoprotein	0.0199	0.2537	0.4561
Toxoplasma gondii	ATP-binding cassette sub-family B member 5	0.0199	0.2537	0.2994
Echinococcus multilocularis	ATP binding cassette sub family B	0.0199	0.2537	0.2537
Trypanosoma cruzi	ATP-binding cassette protein subfamily G	0.0074	0.0809	0.1429
Echinococcus multilocularis	ATP binding cassette sub family B	0.0613	0.8266	0.8266
Echinococcus multilocularis	multidrug resistance protein 1	0.0437	0.5838	0.5838
Brugia malayi	hypothetical protein	0.0043	0.0391	0.0391
Echinococcus multilocularis	dnaJ subfamily B	0.0494	0.6619	0.6619
Onchocerca volvulus		0.0254	0.3303	0.3921
Loa Loa (eye worm)	ABC transporter	0.0199	0.2537	0.2537
Entamoeba histolytica	ABC transporter, putative	0.0416	0.5538	0.6407
Trypanosoma cruzi	ABC transporter, mitochondrial, putative	0.0199	0.2537	0.4561
Echinococcus granulosus	multidrug resistance associated protein 7	0.0199	0.2537	0.2537
Toxoplasma gondii	ATP-binding cassette G family transporter ABCG84	0.0416	0.5538	0.6565
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0196	0.25	0.25
Trypanosoma cruzi	hypothetical protein, conserved	0.0074	0.0809	0.1429
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0196	0.25	0.25
Plasmodium vivax	ataxin-2 like protein, putative	0.0137	0.1688	0.1984
Leishmania major	ATP-binding cassette protein subfamily G, member 2, putative	0.0074	0.0809	0.0938
Loa Loa (eye worm)	hypothetical protein	0.0187	0.2377	0.2377
Loa Loa (eye worm)	hypothetical protein	0.0265	0.3459	0.3459
Echinococcus granulosus	ATP binding cassette subfamily B MDR:TAP	0.0625	0.8425	0.8425
Toxoplasma gondii	ABC transporter transmembrane region domain-containing protein	0.0199	0.2537	0.2994
Leishmania major	ATP-binding cassette protein subfamily B, member 1, putative	0.0199	0.2537	0.2994
Trypanosoma brucei	ABC transporter, putative	0.0416	0.5538	1
Echinococcus granulosus	multidrug resistance associated protein 1	0.0199	0.2537	0.2537
Trypanosoma cruzi	hypothetical protein, conserved	0.0074	0.0809	0.1429
Trypanosoma brucei	ABC transporter, mitochondrial, putative	0.0199	0.2537	0.4561
Trichomonas vaginalis	ATP-binding cassette transporter, putative	0.0625	0.8425	1
Echinococcus multilocularis	cpg binding protein	0.0037	0.0297	0.0297
Echinococcus granulosus	5'partial\|ATP binding cassette sub family B	0.0613	0.8266	0.8266
Echinococcus multilocularis	ATP binding cassette sub family B	0.0199	0.2537	0.2537
Trichomonas vaginalis	lipid A export ATP-binding/permease protein msba, putative	0.0625	0.8425	1
Brugia malayi	MH2 domain containing protein	0.0034	0.026	0.026
Loa Loa (eye worm)	hypothetical protein	0.0199	0.2537	0.2537
Trichomonas vaginalis	ABC transporter, putative	0.0625	0.8425	1
Schistosoma mansoni	hypothetical protein	0.0181	0.2298	0.2298
Loa Loa (eye worm)	hypothetical protein	0.016	0.1996	0.1996
Echinococcus multilocularis	ATP binding cassette sub family G	0.0416	0.5538	0.5538
Echinococcus granulosus	ATP binding cassette subfamily B MDR:TAP	0.0625	0.8425	0.8425
Brugia malayi	latrophilin 2 splice variant baaae	0.0181	0.2298	0.2298
Echinococcus multilocularis		0.0199	0.2537	0.2537
Echinococcus multilocularis	multidrug resistance associated protein 7	0.0199	0.2537	0.2537
Echinococcus multilocularis	Ataxin 2, N terminal,domain containing protein	0.0062	0.0641	0.0641
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0084	0.0951	0.0951
Toxoplasma gondii	ABC transporter transmembrane region domain-containing protein	0.0199	0.2537	0.2994
Loa Loa (eye worm)	nuclear factor I	0.0019	0.005	0.005
Wolbachia endosymbiont of Brugia malayi	ABC-type multidrug transport system, ATPase and permease component	0.0199	0.2537	0.5
Plasmodium vivax	ABC transporter B family member 7, putative	0.0199	0.2537	0.2994
Plasmodium vivax	ABC transporter B family member 5, putative	0.0199	0.2537	0.2994
Echinococcus multilocularis	multidrug resistance associated protein 1	0.0199	0.2537	0.2537
Trichomonas vaginalis	ABC transporter, putative	0.0625	0.8425	1
Echinococcus granulosus	ATP binding cassette subfamily B MDR:TAP	0.0625	0.8425	0.8425
Schistosoma mansoni	smdr1	0.0199	0.2537	0.2537
Leishmania major	p-glycoprotein	0.0625	0.8425	1
Echinococcus granulosus	ATP binding cassette sub family G	0.0416	0.5538	0.5538
Plasmodium vivax	ABC transporter B family member 6, putative	0.0199	0.2537	0.2994
Brugia malayi	MH1 domain containing protein	0.0019	0.005	0.005
Toxoplasma gondii	ABC transporter, putative	0.0199	0.2537	0.2994
Mycobacterium ulcerans	transmembrane ABC transporter ATP-binding protein	0.0199	0.2537	0.3861
Toxoplasma gondii	ATP-binding cassette G family transporter ABCG89	0.0074	0.0809	0.0938
Trypanosoma brucei	multidrug resistance-associated protein, putative	0.0199	0.2537	0.4561
Plasmodium falciparum	multidrug resistance protein 2	0.0199	0.2537	0.2994
Loa Loa (eye worm)	hypothetical protein	0.0199	0.2537	0.2537
Plasmodium falciparum	multidrug resistance protein 1	0.0625	0.8425	1
Plasmodium vivax	ABC transporter B family member 3, putative	0.0199	0.2537	0.2994
Entamoeba histolytica	P-glycoprotein-2	0.0625	0.8425	1
Echinococcus granulosus	ATP binding cassette sub family G	0.0416	0.5538	0.5538
Brugia malayi	RNA recognition motif domain containing protein	0.0738	1	1
Loa Loa (eye worm)	ABC transporter transmembrane region family protein	0.0199	0.2537	0.2537
Brugia malayi	MH1 domain containing protein	0.0019	0.005	0.005
Schistosoma mansoni	tar DNA-binding protein	0.0738	1	1
Echinococcus multilocularis	mothers against decapentaplegic 5	0.0034	0.026	0.026
Echinococcus multilocularis	isocitrate dehydrogenase	0.0017	0.0021	0.0021
Loa Loa (eye worm)	hypothetical protein	0.0181	0.2298	0.2298
Toxoplasma gondii	ATP-binding cassette G family transporter ABCG96	0.0074	0.0809	0.0938
Leishmania major	ATP-binding cassette protein subfamily B, member 3, putative	0.0199	0.2537	0.2994
Schistosoma mansoni	ATP-binding cassette sub-family B member 6 mitochondrial precursor (abc6)	0.0187	0.2377	0.2377
Trichomonas vaginalis	lipid A export ATP-binding/permease protein msba, putative	0.0625	0.8425	1
Schistosoma mansoni	tar DNA-binding protein	0.0738	1	1
Schistosoma mansoni	hypothetical protein	0.0062	0.0641	0.0641
Echinococcus multilocularis	ATP binding cassette subfamily B (MDR:TAP)	0.0625	0.8425	0.8425
Trypanosoma cruzi	PAB1-binding protein , putative	0.0137	0.1688	0.3023
Onchocerca volvulus		0.0625	0.8425	1
Entamoeba histolytica	ABC transporter, putative	0.0199	0.2537	0.2671
Plasmodium vivax	ABC transporter G family member 2, putative	0.0416	0.5538	0.6565
Echinococcus granulosus	cpg binding protein	0.0037	0.0297	0.0297
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0196	0.25	0.25
Schistosoma mansoni	multidrug resistance protein	0.0625	0.8425	0.8425
Mycobacterium tuberculosis	Iron-regulated transporter IrtA	0.0199	0.2537	0.2994
Schistosoma mansoni	hypothetical protein	0.0084	0.0951	0.0951
Loa Loa (eye worm)	multidrug resistance protein 3	0.0625	0.8425	0.8425
Leishmania major	ATP-binding cassette protein subfamily G, member 5, putative	0.0074	0.0809	0.0938
Plasmodium falciparum	ataxin-2 like protein, putative	0.0137	0.1688	0.1984
Mycobacterium ulcerans	transmembrane ABC transporter ATP-binding protein	0.0416	0.5538	1
Schistosoma mansoni	tar DNA-binding protein	0.0738	1	1
Loa Loa (eye worm)	hypothetical protein	0.0084	0.0951	0.0951
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0084	0.0951	0.0951
Schistosoma mansoni	multidrug resistance protein	0.0199	0.2537	0.2537
Echinococcus multilocularis	geminin	0.0205	0.2619	0.2619
Entamoeba histolytica	multidrug resistance protein, putative	0.0199	0.2537	0.2671
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0265	0.3459	0.3459
Giardia lamblia	Multidrug resistance-associated protein 1	0.0199	0.2537	0.0532
Brugia malayi	MH2 domain containing protein	0.0034	0.026	0.026
Mycobacterium tuberculosis	Probable conserved transmembrane ATP-binding protein ABC transporter	0.0342	0.4519	0.5352
Echinococcus granulosus	Ataxin 2 N terminaldomain containing protein	0.0062	0.0641	0.0641
Trypanosoma cruzi	ABC transporter, putative	0.0074	0.0809	0.1429
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0196	0.25	0.25
Plasmodium falciparum	ABC transporter B family member 6, putative	0.0199	0.2537	0.2994
Mycobacterium ulcerans	component linked with the assembly of cytochrome transport transmembrane ATP-binding protein ABC transporter CydD	0.0199	0.2537	0.3861
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0196	0.25	0.25
Entamoeba histolytica	ATP-binding cassette sub-family G1, putative	0.0062	0.0649	0.0322
Entamoeba histolytica	P-glycoprotein 5, putative	0.0625	0.8425	1
Echinococcus granulosus	ATP binding cassette subfamily B MDR:TAP	0.0625	0.8425	0.8425
Echinococcus multilocularis	GPCR, family 2	0.0084	0.0951	0.0951
Trichomonas vaginalis	ATP-binding cassette transporter, putative	0.0625	0.8425	1
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0265	0.3459	0.3459
Trypanosoma cruzi	multidrug resistance-associated protein, putative	0.0199	0.2537	0.4561
Loa Loa (eye worm)	MH1 domain-containing protein	0.0034	0.026	0.026
Loa Loa (eye worm)	ABC transporter	0.0354	0.4678	0.4678
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0265	0.3459	0.3459
Trichomonas vaginalis	abcb9, putative	0.0625	0.8425	1
Trichomonas vaginalis	lipid A export ATP-binding/permease protein msba, putative	0.0625	0.8425	1
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0084	0.0951	0.0951
Plasmodium falciparum	ABC transporter B family member 7, putative	0.0199	0.2537	0.2994
Loa Loa (eye worm)	RNA binding protein	0.0738	1	1
Trypanosoma brucei	multidrug resistance protein E	0.0199	0.2537	0.4561
Mycobacterium tuberculosis	Probable transmembrane multidrug efflux pump	0.0625	0.8425	1
Schistosoma mansoni	multidrug resistance protein	0.0199	0.2537	0.2537
Schistosoma mansoni	hypothetical protein	0.0084	0.0951	0.0951
Brugia malayi	MH2 domain containing protein	0.0499	0.6688	0.6688
Schistosoma mansoni	tar DNA-binding protein	0.0738	1	1
Mycobacterium ulcerans	transmembrane ABC transporter ATP-binding protein	0.0199	0.2537	0.3861
Wolbachia endosymbiont of Brugia malayi	ABC-type protease secretion system, ATPase and permease component, AprD	0.0199	0.2537	0.5
Schistosoma mansoni	smad1 5 8 and	0.0034	0.026	0.026
Brugia malayi	ABC transporter family protein	0.0199	0.2537	0.2537
Echinococcus multilocularis	multidrug resistance protein 1	0.0625	0.8425	0.8425
Schistosoma mansoni	multidrug resistance protein	0.0199	0.2537	0.2537
Brugia malayi	Smad1	0.0034	0.026	0.026
Trypanosoma cruzi	hypothetical protein, conserved	0.0062	0.0649	0.114
Brugia malayi	CXXC zinc finger family protein	0.0035	0.0269	0.0269
Brugia malayi	ABC transporter transmembrane region family protein	0.0199	0.2537	0.2537
Trichomonas vaginalis	multidrug resistance protein 1, 2, putative	0.0625	0.8425	1
Plasmodium vivax	multidrug resistance protein 2, putative	0.0199	0.2537	0.2994
Leishmania major	ATP-binding cassette protein subfamily C, member 6, putative	0.0199	0.2537	0.2994
Trichomonas vaginalis	multidrug resistance protein 1, 2, putative	0.0625	0.8425	1
Entamoeba histolytica	hypothetical protein	0.0199	0.2537	0.2671
Trypanosoma brucei	ABC transporter of the mitochondrion, putative	0.0199	0.2537	0.4561
Brugia malayi	hypothetical protein	0.0062	0.0649	0.0649
Echinococcus granulosus	mothers against decapentaplegic 5	0.0034	0.026	0.026
Brugia malayi	P-glycoprotein-like protein	0.0199	0.2537	0.2537
Schistosoma mansoni	ATP-binding cassette sub-family B member 7 mitochondrial precursor (abc7)	0.0199	0.2537	0.2537
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0084	0.0951	0.0951
Trichomonas vaginalis	ATP-binding cassette transporter, putative	0.0625	0.8425	1
Loa Loa (eye worm)	hypothetical protein	0.0625	0.8425	0.8425
Schistosoma mansoni	TGF-beta signal transducer Smad2	0.0034	0.026	0.026
Brugia malayi	hypothetical protein	0.0199	0.2537	0.2537
Echinococcus granulosus	ATP binding cassette sub family B	0.0199	0.2537	0.2537
Trypanosoma cruzi	ABC transporter, putative	0.0062	0.0649	0.114
Brugia malayi	multidrug resistance protein 3	0.0625	0.8425	0.8425
Entamoeba histolytica	P-glycoprotein 5, putative	0.0187	0.2377	0.2473
Schistosoma mansoni	cpg binding protein	0.0037	0.0297	0.0297
Leishmania major	ABC-thiol transporter	0.0199	0.2537	0.2994
Schistosoma mansoni	multidrug resistance protein	0.0199	0.2537	0.2537
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0196	0.25	0.25
Toxoplasma gondii	ATP-binding cassette transporter ABC.B1	0.0625	0.8425	1
Echinococcus granulosus	NADP dependent isocitrate dehydrogenase	0.0017	0.0021	0.0021
Leishmania major	p-glycoprotein e	0.0199	0.2537	0.2994
Echinococcus granulosus	TGF beta signal transducer SmadC	0.0034	0.026	0.026
Trichomonas vaginalis	lipid A export ATP-binding/permease protein msba, putative	0.0625	0.8425	1
Toxoplasma gondii	ABC transporter transmembrane region domain-containing protein	0.0199	0.2537	0.2994
Plasmodium falciparum	ABC transporter B family member 3, putative	0.0199	0.2537	0.2994
Leishmania major	ATP-binding cassette protein subfamily G, member 1, putative	0.0074	0.0809	0.0938
Plasmodium falciparum	ABC transporter G family member 2	0.0416	0.5538	0.6565
Echinococcus granulosus	multidrug resistance protein 1	0.0437	0.5838	0.5838
Loa Loa (eye worm)	hypothetical protein	0.0625	0.8425	0.8425
Trichomonas vaginalis	multidrug resistance protein 1, 2, putative	0.0625	0.8425	1
Loa Loa (eye worm)	hypothetical protein	0.0137	0.1688	0.1688
Schistosoma mansoni	cpg binding protein	0.0037	0.0297	0.0297
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0074	0.0807	0.0807
Trichomonas vaginalis	lipid A export ATP-binding/permease protein msba, putative	0.0625	0.8425	1
Loa Loa (eye worm)	hypothetical protein	0.0019	0.005	0.005
Mycobacterium ulcerans	transmembrane ABC transporter ATP-binding protein	0.0199	0.2537	0.3861
Leishmania major	ATP-binding cassette protein subfamily C, member 1, putative	0.0199	0.2537	0.2994
Leishmania major	ATP-binding cassette protein subfamily C, member 8, putative	0.0199	0.2537	0.2994
Trypanosoma cruzi	ABC transporter, putative	0.0416	0.5538	1
Echinococcus granulosus	tar DNA binding protein	0.0738	1	1
Toxoplasma gondii	ABC transporter transmembrane region domain-containing protein	0.0199	0.2537	0.2994
Schistosoma mansoni	ABC transporter	0.0354	0.4678	0.4678
Echinococcus granulosus	multidrug resistance protein 1	0.0437	0.5838	0.5838
Echinococcus granulosus	ATP binding cassette sub family G	0.0416	0.5538	0.5538
Trypanosoma brucei	ABC transporter, putative	0.0074	0.0809	0.1429
Leishmania major	ATP-binding cassette protein subfamily G, member 4, putative	0.0416	0.5538	0.6565
Echinococcus granulosus	ATP binding cassette sub family B	0.0199	0.2537	0.2537
Trypanosoma cruzi	ATP-binding cassette protein, putative	0.0416	0.5538	1
Plasmodium falciparum	multidrug resistance-associated protein 1	0.0199	0.2537	0.2994
Mycobacterium tuberculosis	Probable conserved integral membrane protein ABC transporter	0.0062	0.0649	0.0748
Trichomonas vaginalis	ATP-binding cassette transporter, putative	0.0437	0.5838	0.5721
Brugia malayi	ABC transporter family protein	0.0199	0.2537	0.2537
Trypanosoma cruzi	ATP-binding cassette protein subfamily G	0.0074	0.0809	0.1429
Plasmodium vivax	multidrug resistance-associated protein 1, putative	0.0199	0.2537	0.2994
Schistosoma mansoni	Smad4	0.0034	0.026	0.026
Schistosoma mansoni	transcription factor LCR-F1	0.0043	0.0391	0.0391
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0043	0.0391	0.0391
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0196	0.25	0.25
Schistosoma mansoni	smad1 5 8 and	0.0034	0.026	0.026
Echinococcus multilocularis	smad	0.0034	0.026	0.026
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0066	0.0698	0.0806
Trypanosoma brucei	ATP-binding cassette protein subfamily G	0.0074	0.0809	0.1429
Entamoeba histolytica	P-glycoprotein-5	0.0625	0.8425	1
Onchocerca volvulus		0.0035	0.0269	0.032
Schistosoma mansoni	cpg binding protein	0.0035	0.0269	0.0269
Loa Loa (eye worm)	Smad1	0.0034	0.026	0.026
Trichomonas vaginalis	ATP-binding cassette transporter, putative	0.0625	0.8425	1
Entamoeba histolytica	ATP-binding cassette protein, putative	0.0199	0.2537	0.2671
Toxoplasma gondii	ABC transporter transmembrane region domain-containing protein	0.0199	0.2537	0.2994
Echinococcus multilocularis	tar DNA binding protein	0.0738	1	1
Brugia malayi	ABC transporter	0.0187	0.2377	0.2377
Plasmodium falciparum	multidrug resistance-associated protein 2	0.0199	0.2537	0.2994
Schistosoma mansoni	NADP-specific isocitrate dehydrogenase	0.0017	0.0021	0.0021
Brugia malayi	Latrophilin receptor protein 2	0.0084	0.0951	0.0951
Trichomonas vaginalis	ATP-binding cassette transporter, putative	0.0625	0.8425	1
Trichomonas vaginalis	ABC transporter, putative	0.0625	0.8425	1
Toxoplasma gondii	ABC transporter transmembrane region domain-containing protein	0.0625	0.8425	1
Mycobacterium tuberculosis	Probable daunorubicin-dim-transport integral membrane protein ABC transporter DrrC	0.0062	0.0649	0.0748
Echinococcus multilocularis	multidrug resistance protein 1	0.0625	0.8425	0.8425
Trichomonas vaginalis	ABC transporter, putative	0.0625	0.8425	1
Brugia malayi	ABC transporter transmembrane region family protein	0.0199	0.2537	0.2537
Loa Loa (eye worm)	hypothetical protein	0.0613	0.8266	0.8266
Mycobacterium ulcerans	drugs-transport transmembrane ATP-binding protein ABC transporter	0.0199	0.2537	0.3861
Echinococcus multilocularis	ATP binding cassette subfamily B (MDR:TAP)	0.0625	0.8425	0.8425
Echinococcus multilocularis	ATP binding cassette subfamily B (MDR:TAP)	0.0625	0.8425	0.8425
Loa Loa (eye worm)	MH2 domain-containing protein	0.0499	0.6688	0.6688
Schistosoma mansoni	hypothetical protein	0.0494	0.6619	0.6619
Brugia malayi	MH1 domain containing protein	0.0034	0.026	0.026
Brugia malayi	TAR-binding protein	0.0738	1	1
Echinococcus granulosus	smad	0.0034	0.026	0.026
Echinococcus granulosus	GPCR family 2	0.0084	0.0951	0.0951
Loa Loa (eye worm)	ABC transporter	0.0199	0.2537	0.2537
Entamoeba histolytica	P-glycoprotein 6, putative	0.0199	0.2537	0.2671
Mycobacterium ulcerans	transmembrane ABC transporter ATP-binding protein	0.0416	0.5538	1
Leishmania major	hypothetical protein, conserved	0.0137	0.1688	0.1984
Loa Loa (eye worm)	hypothetical protein	0.0062	0.0649	0.0649
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0017	0.0021	0.0021
Schistosoma mansoni	multidrug resistance protein	0.0187	0.2377	0.2377
Echinococcus multilocularis	ATP binding cassette sub family G	0.0416	0.5538	0.5538
Loa Loa (eye worm)	hypothetical protein	0.0199	0.2537	0.2537
Leishmania major	ATP-binding cassette protein subfamily G, member 6, putative	0.0416	0.5538	0.6565
Trichomonas vaginalis	multidrug resistance protein 1, 2, putative	0.0625	0.8425	1
Plasmodium vivax	ABC transporter B family member 4, putative	0.0199	0.2537	0.2994
Loa Loa (eye worm)	hypothetical protein	0.0062	0.0649	0.0649
Loa Loa (eye worm)	pax transcription factor protein 2	0.0254	0.3303	0.3303
Echinococcus granulosus	dnaJ subfamily B	0.0494	0.6619	0.6619
Trichomonas vaginalis	lipid A export ATP-binding/permease protein msba, putative	0.0199	0.2537	0.0264
Mycobacterium tuberculosis	Probable O-antigen/lipopolysaccharide transport integral membrane protein ABC transporter RfbD	0.0062	0.0649	0.0748
Loa Loa (eye worm)	isocitrate dehydrogenase	0.0017	0.0021	0.0021
Entamoeba histolytica	P-glycoprotein-2	0.0625	0.8425	1
Echinococcus granulosus	ATP binding cassette sub family B	0.0187	0.2377	0.2377
Loa Loa (eye worm)	TAR-binding protein	0.0738	1	1
Entamoeba histolytica	P-glyco protein 6, putative	0.0625	0.8425	1
Giardia lamblia	ABC transporter, putative	0.0199	0.2537	0.0532
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0035	0.0269	0.0269
Echinococcus granulosus	multidrug resistance protein 1	0.0625	0.8425	0.8425
Toxoplasma gondii	ABC transporter transmembrane region domain-containing protein	0.0199	0.2537	0.2994
Echinococcus multilocularis	ATP binding cassette subfamily B (MDR:TAP)	0.0625	0.8425	0.8425
Brugia malayi	isocitrate dehydrogenase	0.0017	0.0021	0.0021
Schistosoma mansoni	multidrug resistance protein	0.0625	0.8425	0.8425
Brugia malayi	ABC transporter family protein	0.0354	0.4678	0.4678
Mycobacterium leprae	PROBABLE DRUGS-TRANSPORT TRANSMEMBRANE ATP-BINDING PROTEIN ABC TRANSPORTER	0.0199	0.2537	1
Echinococcus multilocularis	ATP binding cassette sub family B	0.0199	0.2537	0.2537
Mycobacterium leprae	PROBABLE DRUGS-TRANSPORT TRANSMEMBRANE ATP-BINDING PROTEIN ABC TRANSPORTER	0.0199	0.2537	1
Onchocerca volvulus		0.016	0.1996	0.2369
Plasmodium falciparum	ABC transporter B family member 5, putative	0.0199	0.2537	0.2994
Brugia malayi	ABC transporter family protein	0.0199	0.2537	0.2537
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0738	1	1
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0196	0.25	0.25
Loa Loa (eye worm)	transcription factor SMAD2	0.0499	0.6688	0.6688
Brugia malayi	multidrug Resistance Protein family member (mrp-5), putative	0.0199	0.2537	0.2537
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0084	0.0951	0.0951
Trichomonas vaginalis	multidrug resistance protein 1, 2, putative	0.0625	0.8425	1
Echinococcus granulosus	multidrug resistance protein 1	0.0625	0.8425	0.8425
Brugia malayi	MH1 domain containing protein	0.0034	0.026	0.026
Giardia lamblia	ABC transporter	0.0404	0.5378	1
Trichomonas vaginalis	abcb9, putative	0.0625	0.8425	1
Echinococcus multilocularis	TGF beta signal transducer SmadC	0.0034	0.026	0.026
Entamoeba histolytica	P-glycoprotein-2, putative	0.0187	0.2377	0.2473
Toxoplasma gondii	LsmAD domain-containing protein	0.0137	0.1688	0.1984
Echinococcus multilocularis	isocitrate dehydrogenase 2 (NADP+)	0.0017	0.0021	0.0021
Schistosoma mansoni	smad1 5 8 and	0.0034	0.026	0.026
Plasmodium vivax	multidrug resistance protein 1, putative	0.0625	0.8425	1
Trichomonas vaginalis	lipid A export ATP-binding/permease protein msba, putative	0.0625	0.8425	1
Echinococcus granulosus	Smad4	0.0034	0.026	0.026
Trypanosoma cruzi	PAB1-binding protein , putative	0.0137	0.1688	0.3023
Trypanosoma brucei	ATP-binding cassette protein, putative	0.0416	0.5538	1
Trichomonas vaginalis	taga, putative	0.0625	0.8425	1
Leishmania major	ATP-binding cassette protein subfamily C, member 5, putative	0.0199	0.2537	0.2994
Leishmania major	ATP-binding cassette protein subfamily B, member 2, putative	0.0625	0.8425	1
Trypanosoma brucei	multidrug resistance-associated protein, putative	0.0199	0.2537	0.4561
Schistosoma mansoni	hypothetical protein	0.0084	0.0951	0.0951
Giardia lamblia	MRP-like ABC transporter	0.0199	0.2537	0.0532
Schistosoma mansoni	tar DNA-binding protein	0.0738	1	1
Trichomonas vaginalis	ABC transporter, half transporter, putative	0.0625	0.8425	1
Schistosoma mansoni	ABC transporter	0.0062	0.0649	0.0649
Trypanosoma cruzi	multidrug resistance protein E, putative	0.0199	0.2537	0.4561
Entamoeba histolytica	ATP-binding cassette protein, putative	0.0199	0.2537	0.2671
Leishmania major	pentamidine resistance protein 1	0.0199	0.2537	0.2994
Echinococcus multilocularis	ATP binding cassette sub family G	0.0416	0.5538	0.5538
Trichomonas vaginalis	lipid A export ATP-binding/permease protein msba, putative	0.0625	0.8425	1

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 43.9 uM	Inhibition of Mycobacterium smegmatis 155 6His-tagged DNA gyrase B catalytic domain ATPase activity expressed in Escherichia coli BL21 (DE3) pLysS cells assessed as inorganic phosphate release after 120 mins in presence of ATP by malachite green dye based assay	LITERATURE.	27371925

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: CHEMBL3952721

Bibliographic References

No literature references available for this target.

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Detailed information for compound 2139525