TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 461.478 | Formula: C18H18F3N3O4S2
H donors: 2 H acceptors: 4 LogP: 2.94 Rotable bonds: 12
Rule of 5 violations (Lipinski): 1
SMILES: CC(C(=O)NCC(=O)Nc1ccc(c(c1F)F)F)Sc1nc(cs1)CC(=O)OCC
InChi: 1S/C18H18F3N3O4S2/c1-3-28-14(26)6-10-8-29-18(23-10)30-9(2)17(27)22-7-13(25)24-12-5-4-11(19)15(20)16(12)21/h4-5,8-9H,3,6-7H2,1-2H3,(H,22,27)(H,24,25)
InChiKey: WVRXDMORQKPICT-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	ubiquitin conjugating enzyme E2 N	0.0133	0.2885	0.2874
Trichomonas vaginalis	ubiquitin-conjugating enzyme E2, putative	0.0133	0.2885	1
Schistosoma mansoni	hypothetical protein	0.0186	0.4083	0.4083
Loa Loa (eye worm)	hypothetical protein	0.0006	0.003	0.0049
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0011	0.0148	0.0132
Loa Loa (eye worm)	nuclear hormone receptor-like 1	0.0006	0.003	0.0049
Loa Loa (eye worm)	AMP-binding enzyme family protein	0.0008	0.007	0.0189
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.005	0.1028	0.1028
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0011	0.0148	0.0132
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0006	0.003	0.003
Schistosoma mansoni	ecdysone-induced protein 78c (dr-78)	0.0006	0.003	0.003
Brugia malayi	hypothetical protein	0.0006	0.003	0.0049
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0026	0.0484	0.1469
Mycobacterium tuberculosis	Peptide synthetase MbtF (peptide synthase)	0.0008	0.007	0.0546
Schistosoma mansoni	zinc finger protein	0.0005	0.0016	0.0016
Schistosoma mansoni	coup transcription factor	0.0011	0.0148	0.0148
Brugia malayi	F/Y-rich N-terminus family protein	0.001	0.0115	0.0345
Onchocerca volvulus		0.0008	0.007	0.0916
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0011	0.0148	0.046
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0011	0.0148	0.046
Brugia malayi	nuclear receptor RXR	0.0006	0.003	0.0049
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0011	0.0148	0.0132
Brugia malayi	hypothetical protein	0.0006	0.003	0.0049
Brugia malayi	nuclear hormone receptor	0.0011	0.0148	0.046
Trypanosoma cruzi	ubiquitin-conjugating enzyme E2, putative	0.0133	0.2885	0.3569
Onchocerca volvulus		0.0008	0.007	0.0916
Trypanosoma cruzi	ubiquitin-conjugating enzyme E2, putative	0.0133	0.2885	0.3569
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0336	0.1114
Brugia malayi	Steroid receptor seven-up type 2	0.0011	0.0148	0.046
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0011	0.0148	0.0132
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0011	0.0148	0.0132
Echinococcus granulosus	acetyl coenzyme A synthetase cytoplasmic	0.0008	0.007	0.0054
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0484	0.163
Echinococcus multilocularis	dnaJ subfamily B	0.045	1	1
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0011	0.0148	0.0132
Brugia malayi	AMP-binding enzyme family protein	0.0008	0.007	0.0189
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0026	0.0484	0.1469
Trypanosoma cruzi	Enriched in surface-labeled proteome protein 12	0.0359	0.7959	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0011	0.0148	0.046
Brugia malayi	steroid hormone receptor	0.0011	0.0148	0.046
Brugia malayi	ecdysteroid receptor	0.0011	0.0148	0.046
Mycobacterium tuberculosis	Peptide synthetase MbtE (peptide synthase)	0.0008	0.007	0.0546
Schistosoma mansoni	hypothetical protein	0.045	1	1
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0148	0.046
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0148	0.046
Plasmodium vivax	ubiquitin-conjugating enzyme E2 N, putative	0.0133	0.2885	1
Echinococcus multilocularis	ecdysone induced protein 78C	0.0011	0.0148	0.0132
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0011	0.0148	0.046
Entamoeba histolytica	acyl-coA synthetase, putative	0.0026	0.0484	0.1469
Loa Loa (eye worm)	hypothetical protein	0.0006	0.003	0.0049
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.0008	0.007	0.0189
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0011	0.0148	0.0148
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0018	0.0312	0.6071
Leishmania major	4-coumarate:coa ligase-like protein	0.0026	0.0484	0.1469
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.001	0.0118	0.0102
Brugia malayi	AMP-binding enzyme family protein	0.0008	0.007	0.0189
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0011	0.0148	0.0148
Brugia malayi	Ubiquitin conjugating enzyme protein 13	0.0133	0.2885	1
Trypanosoma cruzi	Enriched in surface-labeled proteome protein 12	0.0359	0.7959	1
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0018	0.0312	0.6071
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.005	0.1028	0.3527
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0011	0.0148	0.046
Echinococcus granulosus	cpg binding protein	0.0033	0.0648	0.0633
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0011	0.0148	0.0132
Schistosoma mansoni	nuclear receptor nhr-48	0.0005	0.0016	0.0016
Brugia malayi	AMP-binding enzyme family protein	0.0026	0.0484	0.163
Plasmodium vivax	acyl-CoA synthetase, putative	0.0019	0.0336	0.0943
Echinococcus granulosus	geminin	0.0186	0.4083	0.4074
Onchocerca volvulus		0.0008	0.007	0.0916
Loa Loa (eye worm)	steroid hormone receptor	0.0011	0.0148	0.046
Loa Loa (eye worm)	hypothetical protein	0.0006	0.003	0.0049
Mycobacterium tuberculosis	Phenyloxazoline synthase MbtB (phenyloxazoline synthetase)	0.0008	0.007	0.0546
Trypanosoma cruzi	Enriched in surface-labeled proteome protein 12	0.0359	0.7959	1
Echinococcus granulosus	mixed lineage leukemia protein mll	0.0008	0.0074	0.0059
Trypanosoma brucei	ubiquitin-protein ligase, putative	0.0133	0.2885	0.3569
Onchocerca volvulus	Protein ultraspiracle homolog	0.0011	0.0148	0.2229
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0011	0.0148	0.0132
Loa Loa (eye worm)	AMP-binding enzyme family protein	0.0008	0.007	0.0189
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0026	0.0484	1
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.005	0.1028	0.1014
Brugia malayi	AMP-binding enzyme family protein	0.0008	0.007	0.0189
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0336	0.1114
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0011	0.0148	0.046
Echinococcus granulosus	FTZ F1 alpha	0.0011	0.0148	0.0132
Echinococcus multilocularis	mixed lineage leukemia protein mll	0.0008	0.0074	0.0059
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0011	0.0148	0.046
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0336	0.1114
Plasmodium falciparum	acyl-CoA synthetase	0.0019	0.0336	0.0943
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0011	0.0148	0.0132
Brugia malayi	AMP-binding enzyme family protein	0.0008	0.007	0.0189
Loa Loa (eye worm)	ubiquitin conjugating enzyme protein 13	0.0133	0.2885	1
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0011	0.0148	0.0148
Mycobacterium tuberculosis	Probable peptide synthetase Nrp (peptide synthase)	0.0008	0.007	0.0546
Onchocerca volvulus		0.0026	0.0484	0.7908
Mycobacterium tuberculosis	Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.0019	0.0336	0.6617
Brugia malayi	photoreceptor-specific nuclear receptor	0.0011	0.0148	0.046
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0011	0.0148	0.0148
Loa Loa (eye worm)	hypothetical protein	0.0008	0.007	0.0189
Brugia malayi	Nuclear hormone receptor-like 1	0.0006	0.003	0.0049
Mycobacterium ulcerans	long-chain-fatty-acid--CoA ligase	0.0026	0.0484	1
Brugia malayi	ubiquitin conjugating enzyme protein 13	0.0133	0.2885	1
Trypanosoma cruzi	Enriched in surface-labeled proteome protein 12	0.0359	0.7959	1
Schistosoma mansoni	nuclear hormone receptor superfamily protein-related	0.0005	0.0016	0.0016
Loa Loa (eye worm)	hypothetical protein	0.0006	0.003	0.0049
Schistosoma mansoni	cpg binding protein	0.0032	0.0608	0.0608
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0026	0.0484	1
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0011	0.0148	0.046
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0008	0.0074	0.0074
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0011	0.0148	0.0148
Toxoplasma gondii	histone lysine methyltransferase SET1	0.006	0.1242	0.4163
Mycobacterium ulcerans	long-chain fatty-acid CoA ligase	0.0026	0.0484	1
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0148	0.046
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0011	0.0148	0.0132
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0011	0.0148	0.046
Echinococcus multilocularis	ubiquitin conjugating enzyme E2 N	0.0133	0.2885	0.2874
Brugia malayi	nuclear receptor NHR-88	0.0011	0.0148	0.046
Loa Loa (eye worm)	histone methyltransferase	0.001	0.0118	0.0354
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.005	0.1028	0.3527
Trichomonas vaginalis	antibiotic synthetase, putative	0.0008	0.007	0.004
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0011	0.0148	0.046
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0336	0.1114
Onchocerca volvulus		0.0008	0.007	0.0916
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0336	0.1114
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0026	0.0484	1
Mycobacterium tuberculosis	Probable medium chain fatty-acid-CoA ligase FadD14 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0008	0.007	0.0546
Echinococcus multilocularis	FTZ F1 alpha	0.0011	0.0148	0.0132
Toxoplasma gondii	ubiquitin-conjugating enzyme subfamily protein	0.0133	0.2885	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0011	0.0148	0.046
Mycobacterium tuberculosis	Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase)	0.0026	0.0484	1
Trichomonas vaginalis	ubiquitin-conjugating enzyme E2, putative	0.0133	0.2885	1
Brugia malayi	Nuclear hormone receptor-like 1	0.0011	0.0148	0.046
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.005	0.1028	0.1028
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0018	0.0312	0.6071
Trypanosoma brucei	Enriched in surface-labeled proteome protein 12	0.0359	0.7959	1
Leishmania major	4-coumarate:coa ligase-like protein	0.0026	0.0484	0.1469
Plasmodium falciparum	ubiquitin-conjugating enzyme E2 N, putative	0.0133	0.2885	1
Loa Loa (eye worm)	ubiquitin conjugating enzyme protein 13	0.0133	0.2885	1
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0011	0.0148	0.046
Loa Loa (eye worm)	hypothetical protein	0.0006	0.003	0.0049
Mycobacterium tuberculosis	Possible fatty-acid-CoA ligase FadD1 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0008	0.007	0.0546
Mycobacterium ulcerans	hypothetical protein	0.0026	0.0484	1
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0011	0.0148	0.0148
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0018	0.0312	0.6071
Brugia malayi	Nuclear hormone receptor-like 1	0.0006	0.003	0.0049
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0011	0.0148	0.046
Schistosoma mansoni	nuclear receptor	0.0005	0.0016	0.0016
Schistosoma mansoni	nuclear hormone receptor	0.0005	0.0016	0.0016
Trypanosoma brucei	hypothetical protein, conserved	0.0359	0.7959	1
Echinococcus granulosus	nuclear receptor subfamily 1 group D	0.0006	0.003	0.0014
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0011	0.0148	0.046
Schistosoma mansoni	nuclear hormone receptor	0.0005	0.0016	0.0016
Echinococcus multilocularis	nuclear receptor subfamily 1 group D	0.0006	0.003	0.0014
Mycobacterium tuberculosis	Possible fatty-acid-CoA ligase FadD10 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0008	0.007	0.0546
Schistosoma mansoni	cpg binding protein	0.0033	0.0648	0.0648
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0148	0.046
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD8 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0008	0.007	0.0546
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.005	0.1028	0.1028
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0011	0.0148	0.0148
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0148	0.046
Onchocerca volvulus		0.0011	0.0148	0.2229
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0011	0.0148	0.046
Schistosoma mansoni	cpg binding protein	0.0033	0.0648	0.0648
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0148	0.046
Onchocerca volvulus	Bile acid receptor homolog	0.0011	0.0148	0.2229
Mycobacterium tuberculosis	P-hydroxybenzoyl-AMP ligase FadD22	0.0008	0.007	0.0546
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0026	0.0484	1
Leishmania major	4-coumarate:coa ligase-like protein	0.0026	0.0484	0.1469
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0011	0.0148	0.0132
Leishmania major	ubiquitin-conjugating enzyme e2, putative	0.0133	0.2885	1
Mycobacterium tuberculosis	Bifunctional enzyme MbtA: salicyl-AMP ligase (SAL-AMP ligase) + salicyl-S-ArCP synthetase	0.0008	0.007	0.0546
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.0011	0.0148	0.2229
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0019	0.0336	0.6421
Mycobacterium ulcerans	acyl-CoA synthetase	0.0026	0.0484	1
Schistosoma mansoni	thyroid hormone receptor	0.0011	0.0148	0.0148
Schistosoma mansoni	nuclear hormone receptor	0.0011	0.0148	0.0148
Entamoeba histolytica	ubiquitin-conjugating enzyme family protein	0.0133	0.2885	1
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0011	0.0148	0.0132
Chlamydia trachomatis	acylglycerophosphoethanolamine acyltransferase	0.0019	0.0336	0.5
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.005	0.1028	0.1014
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0011	0.0148	0.046
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0032	0.0608	0.2062
Schistosoma mansoni	nuclear receptor	0.0005	0.0016	0.0016
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0011	0.0148	0.046
Echinococcus multilocularis	geminin	0.0186	0.4083	0.4074
Brugia malayi	acetyl-Coenzyme A synthetase 2	0.0008	0.007	0.0189
Schistosoma mansoni	hepatocyte nuclear factor 4-alpha (hnf-4-alpha)	0.0005	0.0016	0.0016
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0011	0.0148	0.046
Brugia malayi	CXXC zinc finger family protein	0.0032	0.0608	0.2062
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0148	0.046
Schistosoma mansoni	thyroid hormone receptor	0.0011	0.0148	0.0148
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0008	0.0074	0.0059
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0067	0.1403	0.1403
Brugia malayi	AMP-binding enzyme family protein	0.0026	0.0484	0.163
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0011	0.0148	0.046
Schistosoma mansoni	ubiquitin conjugating enzyme 13	0.0133	0.2885	0.2885
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.005	0.1028	0.1014
Schistosoma mansoni	acetyl-CoA synthetase	0.0008	0.007	0.007
Mycobacterium ulcerans	acyl-CoA synthetase	0.0026	0.0484	1
Trypanosoma cruzi	Enriched in surface-labeled proteome protein 12	0.0359	0.7959	1
Echinococcus multilocularis	acetyl coenzyme A synthetase, cytoplasmic	0.0008	0.007	0.0054
Loa Loa (eye worm)	oxidoreductase	0.0008	0.007	0.0189
Schistosoma mansoni	retinoic acid receptor RXR	0.0011	0.0148	0.0148
Loa Loa (eye worm)	hypothetical protein	0.0008	0.007	0.0189
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0011	0.0148	0.0132
Trypanosoma brucei	hypothetical protein, conserved	0.0359	0.7959	1
Echinococcus granulosus	ecdysone induced protein 78C	0.0011	0.0148	0.0132
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0484	0.163
Mycobacterium ulcerans	long-chain-fatty-acid-CoA ligase	0.0026	0.0484	1
Mycobacterium ulcerans	acyl-CoA synthetase	0.0026	0.0484	1
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.001	0.0118	0.0102
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0008	0.0074	0.0059
Echinococcus multilocularis	cpg binding protein	0.0033	0.0648	0.0633
Onchocerca volvulus		0.0032	0.0608	1
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0011	0.0148	0.046
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0484	0.163
Brugia malayi	AMP-binding enzyme family protein	0.0026	0.0484	0.163
Mycobacterium tuberculosis	Fatty-acid-CoA synthetase FadD17 (fatty-acid-CoA synthase) (fatty-acid-CoA ligase)	0.0008	0.007	0.0546
Schistosoma mansoni	RAR-like nuclear receptor	0.0011	0.0148	0.0148
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0148	0.046
Schistosoma mansoni	hypothetical protein	0.0186	0.4083	0.4083
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0011	0.0148	0.0132
Trichomonas vaginalis	antibiotic synthetase, putative	0.0008	0.007	0.004
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.005	0.1028	0.1014

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	22.3872 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b: Cytotox Counterscreen. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588855, AID588860]	ChEMBL.	No reference
Potency (functional)	29.081 uM	PUBCHEM_BIOASSAY: qHTS screen for small molecules that inhibit ELG1-dependent DNA repair in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493107, AID493125]	ChEMBL.	No reference
Potency (functional)	89.1251 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623]	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.

In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

ChEMBL: CHEMBL1728568

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1557438