TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 349.334 | Formula: C20H13F2N3O
H donors: 2 H acceptors: 3 LogP: 4.92 Rotable bonds: 3
Rule of 5 violations (Lipinski): 1
SMILES: Oc1cccc(c1)Nc1nc(nc2c1cc(F)cc2)c1cccc(c1)F
InChi: 1S/C20H13F2N3O/c21-13-4-1-3-12(9-13)19-24-18-8-7-14(22)10-17(18)20(25-19)23-15-5-2-6-16(26)11-15/h1-11,26H,(H,23,24,25)
InChiKey: RGCNNZXIHOUMOQ-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
Loa Loa (eye worm)	hypothetical protein	0.0139	0.0627	0.1573
Mycobacterium ulcerans	class a beta-lactamase, BlaC	0.0142	0.064	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0139	0.0627	0.1573
Loa Loa (eye worm)	hypothetical protein	0.0074	0.0272	0.0683
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0139	0.0627	0.1573
Brugia malayi	nuclear receptor RXR	0.0074	0.0272	0.0683
Loa Loa (eye worm)	hypothetical protein	0.0153	0.0699	0.1753
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0139	0.0627	0.0678
Echinococcus granulosus	smad	0.0052	0.0155	0.0168
Loa Loa (eye worm)	hypothetical protein	0.0066	0.023	0.0576
Echinococcus granulosus	PHD finger protein rhinoceros	0.0029	0.0034	0.0036
Echinococcus multilocularis	lysine specific demethylase 5A	0.0036	0.0067	0.0067
Brugia malayi	nuclear hormone receptor	0.0066	0.023	0.0576
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0139	0.0627	0.0678
Echinococcus granulosus	Mitotic checkpoint protein PRCC C terminal	0.1737	0.9248	1
Brugia malayi	tailless protein	0.0066	0.023	0.0576
Echinococcus multilocularis	smad	0.0052	0.0155	0.0155
Echinococcus granulosus	dihydrolipoamide dehydrogenase	0.005	0.0146	0.0158
Echinococcus multilocularis	retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha	0.0066	0.023	0.023
Plasmodium falciparum	thioredoxin reductase	0.0145	0.0657	1
Loa Loa (eye worm)	hypothetical protein	0.0074	0.0272	0.0683
Onchocerca volvulus		0.0066	0.023	0.0838
Echinococcus multilocularis	Smad4	0.0052	0.0155	0.0155
Brugia malayi	Pax transcription factor protein 2	0.0531	0.2741	0.6876
Plasmodium vivax	thioredoxin reductase, putative	0.0145	0.0657	1
Mycobacterium ulcerans	lipoprotein LpqF	0.0068	0.0242	0.1947
Schistosoma mansoni	retinoic acid receptor RXR	0.0139	0.0627	0.0627
Loa Loa (eye worm)	nuclear hormone receptor	0.0066	0.023	0.0576
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0139	0.0627	0.0627
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0139	0.0627	0.0627
Brugia malayi	nuclear receptor NHR-88	0.0066	0.023	0.0576
Echinococcus granulosus	mothers against decapentaplegic 5	0.0052	0.0155	0.0168
Mycobacterium leprae	PROBABLE NADH DEHYDROGENASE NDH	0.0331	0.166	0.8768
Brugia malayi	Nuclear hormone receptor-like 1	0.0139	0.0627	0.1573
Brugia malayi	nuclear receptor NHR-88	0.0139	0.0627	0.1573
Loa Loa (eye worm)	nuclear receptor nhr-7B	0.0066	0.023	0.0576
Echinococcus multilocularis	mothers against decapentaplegic 5	0.0052	0.0155	0.0155
Loa Loa (eye worm)	hypothetical protein	0.0066	0.023	0.0576
Brugia malayi	Bromodomain containing protein	0.0029	0.0034	0.0085
Onchocerca volvulus	Nuclear receptor subfamily 6 group A member 1 homolog	0.0066	0.023	0.0838
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0074	0.0272	0.0272
Echinococcus multilocularis	thioredoxin glutathione reductase	0.0145	0.0657	0.0657
Brugia malayi	conserved hypotetical protein	0.0066	0.023	0.0576
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0139	0.0627	0.0678
Loa Loa (eye worm)	nuclear hormone receptor-like 1	0.0074	0.0272	0.0683
Plasmodium vivax	glutathione reductase, putative	0.0145	0.0657	1
Mycobacterium tuberculosis	Probable conserved lipoprotein LpqF	0.0068	0.0242	0.0562
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0139	0.0627	0.0627
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0034	0.0085
Brugia malayi	glutathione reductase	0.0145	0.0657	0.1649
Loa Loa (eye worm)	hypothetical protein	0.0029	0.003	0.0075
Wolbachia endosymbiont of Brugia malayi	dihydrolipoamide dehydrogenase E3 component	0.005	0.0146	0.5
Echinococcus multilocularis	dihydrolipoamide dehydrogenase	0.005	0.0146	0.0146
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0139	0.0627	0.1573
Echinococcus granulosus	Transcription factor JmjC domain containing protein	0.0096	0.0395	0.0428
Loa Loa (eye worm)	hypothetical protein	0.0139	0.0627	0.1573
Trypanosoma brucei	beta lactamase	0.0068	0.0242	0.1882
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0139	0.0627	0.0627
Brugia malayi	Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein	0.0037	0.0074	0.0186
Brugia malayi	nuclear receptor NHR-67	0.0066	0.023	0.0576
Echinococcus granulosus	nuclear receptor subfamily 4 group A	0.0066	0.023	0.0248
Chlamydia trachomatis	dihydrolipoyl dehydrogenase	0.005	0.0146	0.5
Toxoplasma gondii	NADPH-glutathione reductase	0.005	0.0146	0.1799
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0139	0.0627	0.1573
Echinococcus granulosus	nuclear receptor nhr 48	0.0066	0.023	0.0248
Schistosoma mansoni	hypothetical protein	0.1737	0.9248	0.9248
Schistosoma mansoni	smad1 5 8 and	0.0052	0.0155	0.0155
Schistosoma mansoni	zinc finger protein	0.0066	0.023	0.023
Schistosoma mansoni	jumonji domain containing protein	0.0077	0.0288	0.0288
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0139	0.0627	0.1573
Toxoplasma gondii	pyruvate dehydrogenase complex subunit PDH-E3II	0.005	0.0146	0.1799
Treponema pallidum	NADH oxidase	0.005	0.0146	0.5
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0139	0.0627	0.0627
Schistosoma mansoni	nuclear receptor nhr-48	0.0066	0.023	0.023
Echinococcus multilocularis	peregrin	0.0029	0.0034	0.0034
Brugia malayi	hypothetical protein	0.0066	0.023	0.0576
Schistosoma mansoni	hypothetical protein	0.004	0.009	0.009
Mycobacterium tuberculosis	NADPH-dependent mycothiol reductase Mtr	0.0145	0.0657	0.2985
Brugia malayi	hypothetical protein	0.0066	0.023	0.0576
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.0139	0.0627	0.2288
Brugia malayi	jmjC domain containing protein	0.0036	0.0067	0.0169
Echinococcus granulosus	TGF beta signal transducer SmadC	0.0052	0.0155	0.0168
Brugia malayi	Nuclear hormone receptor E75	0.0066	0.023	0.0576
Brugia malayi	nuclear receptor RXR	0.0066	0.023	0.0576
Schistosoma mansoni	coup transcription factor	0.0139	0.0627	0.0627
Entamoeba histolytica	hypothetical protein	0.004	0.009	0.5
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0139	0.0627	0.0627
Loa Loa (eye worm)	hypothetical protein	0.0074	0.0272	0.0683
Brugia malayi	jmjC domain containing protein	0.0096	0.0395	0.0992
Brugia malayi	nuclear hormone receptor family member nhr-6	0.0066	0.023	0.0576
Schistosoma mansoni	ecdysone-induced protein 78c (dr-78)	0.0074	0.0272	0.0272
Loa Loa (eye worm)	jmjC domain-containing protein	0.0061	0.0203	0.0509
Trichomonas vaginalis	mercuric reductase, putative	0.005	0.0146	0.5
Brugia malayi	MH1 domain containing protein	0.0029	0.003	0.0075
Plasmodium vivax	dihydrolipoyl dehydrogenase, apicoplast, putative	0.005	0.0146	0.1799
Onchocerca volvulus		0.0531	0.2741	1
Mycobacterium tuberculosis	Probable NADH dehydrogenase Ndh	0.0331	0.166	0.8837
Schistosoma mansoni	nuclear receptor	0.0066	0.023	0.023
Schistosoma mansoni	Smad4	0.0052	0.0155	0.0155
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0139	0.0627	0.0627
Echinococcus granulosus	thyroid hormone receptor alpha	0.0066	0.023	0.0248
Schistosoma mansoni	smad	0.0052	0.0155	0.0155
Plasmodium falciparum	dihydrolipoyl dehydrogenase, apicoplast	0.005	0.0146	0.1799
Loa Loa (eye worm)	MH1 domain-containing protein	0.0052	0.0155	0.0389
Schistosoma mansoni	smad1 5 8 and	0.0052	0.0155	0.0155
Mycobacterium tuberculosis	NAD(P)H quinone reductase LpdA	0.0368	0.1859	1
Brugia malayi	hypothetical protein	0.0153	0.0699	0.1753
Loa Loa (eye worm)	hypothetical protein	0.0139	0.0627	0.1573
Loa Loa (eye worm)	hypothetical protein	0.0139	0.0627	0.1573
Schistosoma mansoni	thyroid hormone receptor	0.1876	1	1
Echinococcus multilocularis	nuclear receptor nhr 48	0.0066	0.023	0.023
Mycobacterium tuberculosis	Probable reductase	0.0331	0.166	0.8837
Schistosoma mansoni	smad1 5 8 and	0.0052	0.0155	0.0155
Loa Loa (eye worm)	hypothetical protein	0.0066	0.023	0.0576
Brugia malayi	MH1 domain containing protein	0.0052	0.0155	0.0389
Plasmodium falciparum	thioredoxin reductase	0.005	0.0146	0.1799
Loa Loa (eye worm)	hypothetical protein	0.0066	0.023	0.0576
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0139	0.0627	0.1573
Onchocerca volvulus	Protein ultraspiracle homolog	0.0139	0.0627	0.2288
Echinococcus multilocularis	nuclear receptor subfamily 4 group A	0.0066	0.023	0.023
Brugia malayi	hypothetical protein	0.0074	0.0272	0.0683
Loa Loa (eye worm)	hypothetical protein	0.0074	0.0272	0.0683
Echinococcus multilocularis	Mitotic checkpoint protein PRCC, C terminal	0.1737	0.9248	0.9248
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0139	0.0627	0.1573
Echinococcus granulosus	Smad4	0.0052	0.0155	0.0168
Brugia malayi	nuclear hormone receptor	0.0139	0.0627	0.1573
Echinococcus multilocularis	PHD finger protein rhinoceros	0.0029	0.0034	0.0034
Loa Loa (eye worm)	pax transcription factor protein 2	0.0531	0.2741	0.6876
Mycobacterium tuberculosis	Probable oxidoreductase	0.0368	0.1859	1
Brugia malayi	hypothetical protein	0.0074	0.0272	0.0683
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0139	0.0627	0.0678
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0139	0.0627	0.0627
Brugia malayi	Steroid receptor seven-up type 2	0.0139	0.0627	0.1573
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0066	0.023	0.0248
Trichomonas vaginalis	glutathione reductase, putative	0.005	0.0146	0.5
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0139	0.0627	0.0678
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0139	0.0627	0.1573
Schistosoma mansoni	bromodomain-containing nuclear protein 1 brd1	0.0029	0.0034	0.0034
Brugia malayi	orphan nuclear receptor NR2E1	0.0066	0.023	0.0576
Brugia malayi	Thioredoxin reductase	0.0145	0.0657	0.1649
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0139	0.0627	0.1573
Schistosoma mansoni	nuclear receptor	0.0066	0.023	0.023
Loa Loa (eye worm)	steroid hormone receptor	0.0139	0.0627	0.1573
Schistosoma mansoni	hypothetical protein	0.0029	0.0034	0.0034
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0139	0.0627	0.0678
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0139	0.0627	0.1573
Schistosoma mansoni	hepatocyte nuclear factor 4-alpha (hnf-4-alpha)	0.0066	0.023	0.023
Loa Loa (eye worm)	hypothetical protein	0.0066	0.023	0.0576
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0139	0.0627	0.0627
Brugia malayi	PHD-finger family protein	0.0029	0.0034	0.0085
Echinococcus multilocularis	Transcription factor, JmjC domain containing protein	0.0096	0.0395	0.0395
Plasmodium vivax	dihydrolipoyl dehydrogenase, mitochondrial, putative	0.005	0.0146	0.1799
Mycobacterium tuberculosis	Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras	0.0368	0.1859	1
Loa Loa (eye worm)	hypothetical protein	0.0139	0.0627	0.1573
Brugia malayi	nuclear receptor subfamily 1, group D, member 1, putative	0.0066	0.023	0.0576
Loa Loa (eye worm)	MH2 domain-containing protein	0.0762	0.3987	1
Loa Loa (eye worm)	hypothetical protein	0.0066	0.023	0.0576
Loa Loa (eye worm)	hypothetical protein	0.0066	0.023	0.0576
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0139	0.0627	0.0627
Onchocerca volvulus		0.0153	0.0699	0.2549
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0066	0.023	0.0248
Trypanosoma brucei	trypanothione reductase	0.0145	0.0657	1
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0139	0.0627	0.1573
Onchocerca volvulus		0.0066	0.023	0.0838
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0139	0.0627	0.1573
Wolbachia endosymbiont of Brugia malayi	dihydrolipoamide dehydrogenase E3 component	0.005	0.0146	0.5
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0139	0.0627	0.0627
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.004	0.009	0.0097
Echinococcus multilocularis	FTZ F1 alpha	0.0139	0.0627	0.0627
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.004	0.009	0.009
Loa Loa (eye worm)	jmjC domain-containing protein	0.0036	0.0067	0.0169
Schistosoma mansoni	nuclear hormone receptor	0.0139	0.0627	0.0627
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0066	0.023	0.0248
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0139	0.0627	0.1573
Loa Loa (eye worm)	DR-78	0.0066	0.023	0.0576
Trypanosoma cruzi	trypanothione reductase, putative	0.0145	0.0657	1
Mycobacterium tuberculosis	Putative ferredoxin reductase	0.0331	0.166	0.8837
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0147	0.037
Echinococcus granulosus	thioredoxin glutathione reductase	0.0145	0.0657	0.0711
Entamoeba histolytica	hypothetical protein	0.004	0.009	0.5
Brugia malayi	photoreceptor-specific nuclear receptor	0.0139	0.0627	0.1573
Brugia malayi	MH2 domain containing protein	0.0762	0.3987	1
Brugia malayi	steroid hormone receptor	0.0139	0.0627	0.1573
Echinococcus granulosus	FTZ F1 alpha	0.0139	0.0627	0.0678
Loa Loa (eye worm)	transcription factor SMAD2	0.0762	0.3987	1
Loa Loa (eye worm)	nuclear factor I	0.0029	0.003	0.0075
Loa Loa (eye worm)	Smad1	0.0052	0.0155	0.0389
Loa Loa (eye worm)	hypothetical protein	0.0066	0.023	0.0576
Loa Loa (eye worm)	PHD-finger family protein	0.0029	0.0034	0.0085
Brugia malayi	alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase	0.0037	0.0074	0.0186
Brugia malayi	MH1 domain containing protein	0.0029	0.003	0.0075
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0036	0.0067	0.0067
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0066	0.023	0.023
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0139	0.0627	0.1573
Brugia malayi	ecdysteroid receptor	0.0139	0.0627	0.1573
Loa Loa (eye worm)	nuclear receptor NHR-67	0.0066	0.023	0.0576
Toxoplasma gondii	thioredoxin reductase	0.0145	0.0657	1
Echinococcus multilocularis	nuclear receptor subfamily 1 group D	0.0074	0.0272	0.0272
Brugia malayi	MH2 domain containing protein	0.0052	0.0155	0.0389
Entamoeba histolytica	hypothetical protein	0.004	0.009	0.5
Echinococcus granulosus	peregrin	0.0029	0.0034	0.0036
Echinococcus granulosus	jumonji domain containing protein	0.0041	0.0096	0.0104
Loa Loa (eye worm)	hypothetical protein	0.0139	0.0627	0.1573
Mycobacterium leprae	DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE	0.0368	0.1859	1
Brugia malayi	Nuclear hormone receptor-like 1	0.0074	0.0272	0.0683
Plasmodium falciparum	dihydrolipoyl dehydrogenase, mitochondrial	0.005	0.0146	0.1799
Echinococcus granulosus	nuclear receptor subfamily 1 group D	0.0074	0.0272	0.0294
Onchocerca volvulus	Bile acid receptor homolog	0.0139	0.0627	0.2288
Brugia malayi	ecdysone receptor	0.0066	0.023	0.0576
Loa Loa (eye worm)	hypothetical protein	0.0066	0.023	0.0576
Echinococcus granulosus	ecdysone induced protein 78C	0.0139	0.0627	0.0678
Plasmodium falciparum	glutathione reductase	0.0145	0.0657	1
Schistosoma mansoni	nuclear hormone receptor	0.0066	0.023	0.023
Echinococcus multilocularis	jumonji domain containing protein	0.0041	0.0096	0.0096
Loa Loa (eye worm)	hypothetical protein	0.0066	0.023	0.0576
Schistosoma mansoni	nuclear hormone receptor superfamily protein-related	0.0066	0.023	0.023
Mycobacterium tuberculosis	Probable membrane NADH dehydrogenase NdhA	0.0331	0.166	0.8837
Echinococcus multilocularis	ecdysone induced protein 78C	0.0139	0.0627	0.0627
Brugia malayi	Smad1	0.0052	0.0155	0.0389
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0139	0.0627	0.1573
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0139	0.0627	0.1573
Schistosoma mansoni	RAR-like nuclear receptor	0.0139	0.0627	0.0627
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0139	0.0627	0.1573
Leishmania major	trypanothione reductase	0.0145	0.0657	1
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0139	0.0627	0.0627
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0139	0.0627	0.0627
Echinococcus granulosus	lysine specific demethylase 5A	0.0036	0.0067	0.0073
Brugia malayi	dihydrolipoyl dehydrogenase, mitochondrial precursor, putative	0.005	0.0146	0.0366
Loa Loa (eye worm)	hypothetical protein	0.0139	0.0627	0.1573
Schistosoma mansoni	dihydrolipoamide dehydrogenase	0.005	0.0146	0.0146
Schistosoma mansoni	nuclear hormone receptor	0.0066	0.023	0.023
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0066	0.023	0.023
Onchocerca volvulus	Nuclear receptor subfamily 6 group A member 1 homolog	0.0066	0.023	0.0838
Mycobacterium tuberculosis	Class a beta-lactamase BlaC	0.0142	0.064	0.2885
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0139	0.0627	0.1573
Brugia malayi	MH1 domain containing protein	0.0052	0.0155	0.0389
Loa Loa (eye worm)	glutathione reductase	0.0145	0.0657	0.1649
Loa Loa (eye worm)	MH2 domain-containing protein	0.0052	0.0155	0.0389
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0139	0.0627	0.0678
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0036	0.0067	0.0067
Loa Loa (eye worm)	hypothetical protein	0.0066	0.023	0.0576
Onchocerca volvulus		0.0139	0.0627	0.2288
Mycobacterium tuberculosis	Probable dehydrogenase	0.0331	0.166	0.8837
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0139	0.0627	0.1573
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0066	0.023	0.023
Brugia malayi	nuclear hormone receptor family member odr-7	0.0066	0.023	0.0576
Schistosoma mansoni	transcription factor LCR-F1	0.004	0.009	0.009
Onchocerca volvulus	Alhambra homolog	0.0029	0.0034	0.0123
Brugia malayi	hypothetical protein	0.004	0.009	0.0226
Brugia malayi	Nuclear hormone receptor-like 1	0.0074	0.0272	0.0683
Schistosoma mansoni	thyroid hormone receptor	0.1876	1	1
Giardia lamblia	NADH oxidase lateral transfer candidate	0.005	0.0146	1
Loa Loa (eye worm)	hypothetical protein	0.0066	0.023	0.0576
Loa Loa (eye worm)	hypothetical protein	0.0139	0.0627	0.1573
Loa Loa (eye worm)	thioredoxin reductase	0.0145	0.0657	0.1649
Echinococcus multilocularis	TGF beta signal transducer SmadC	0.0052	0.0155	0.0155
Plasmodium falciparum	glutathione reductase	0.005	0.0146	0.1799
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0139	0.0627	0.1573
Brugia malayi	Nuclear hormone receptor E75	0.0066	0.023	0.0576
Schistosoma mansoni	TGF-beta signal transducer Smad2	0.0052	0.0155	0.0155
Loa Loa (eye worm)	hypothetical protein	0.0074	0.0272	0.0683
Brugia malayi	MH2 domain containing protein	0.0052	0.0155	0.0389
Loa Loa (eye worm)	hypothetical protein	0.0066	0.023	0.0576
Entamoeba histolytica	hypothetical protein	0.004	0.009	0.5
Mycobacterium tuberculosis	Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB	0.0331	0.166	0.8837

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (functional)	= 33.32 uM	Cytotoxicity against human U2OS cells after 48 hrs by MTT assay	ChEMBL.	21514013
IC50 (functional)	> 50 uM	Cytotoxicity against human HL60 cells after 48 hrs by MTT assay	ChEMBL.	21514013
IC50 (functional)	> 50 uM	Cytotoxicity against human U937 cells after 48 hrs by MTT assay	ChEMBL.	21514013
IC50 (functional)	> 50 uM	Cytotoxicity against human COLO205 cells after 48 hrs by MTT assay	ChEMBL.	21514013
IC50 (functional)	> 50 uM	Cytotoxicity against human MCF7 cells after 48 hrs by MTT assay	ChEMBL.	21514013
IC50 (functional)	> 50 uM	Cytotoxicity against human MDA-MB-231 cells after 48 hrs by MTT assay	ChEMBL.	21514013

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: CHEMBL1818176

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1107945