TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 465.54 | Formula: C30H27NO4
H donors: 1 H acceptors: 3 LogP: 6.59 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: Cc1ccc(cc1)C(=O)/C=C/c1cc2cc(C(=O)NC3CCCCC3)c(=O)oc2c2c1cccc2
InChi: 1S/C30H27NO4/c1-19-11-13-20(14-12-19)27(32)16-15-21-17-22-18-26(29(33)31-23-7-3-2-4-8-23)30(34)35-28(22)25-10-6-5-9-24(21)25/h5-6,9-18,23H,2-4,7-8H2,1H3,(H,31,33)/b16-15+
InChiKey: BLRURPUSHSYTDN-FOCLMDBBSA-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
Mycobacterium ulcerans	dihydrolipoamide dehydrogenase, LpdB	0.001	0.0676	1
Mycobacterium tuberculosis	Probable reductase	0.0068	0.7022	0.8936
Trichomonas vaginalis	DNA helicase recq, putative	0.0007	0.0264	0.103
Brugia malayi	Cytochrome P450 family protein	0.0004	0.001	0.0022
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.001	0.0676	0.1618
Echinococcus multilocularis	Endonuclease G	0.0013	0.0936	0.2779
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.0021	0.1864	0.5534
Toxoplasma gondii	GDA1/CD39 (nucleoside phosphatase) family protein	0.0027	0.2563	0.6202
Echinococcus granulosus	cytochrome P450 2K1	0.0004	0.001	0.0029
Brugia malayi	Thrombospondin type 1 domain containing protein	0.0046	0.4558	1
Brugia malayi	Cytochrome P450 family protein	0.0004	0.001	0.0022
Schistosoma mansoni	endonuclease related	0.0013	0.0936	0.0936
Echinococcus multilocularis	ectonucleoside triphosphate diphosphohydrolase	0.0027	0.2563	0.7608
Loa Loa (eye worm)	cytochrome P450 family protein	0.0004	0.001	0.0022
Trypanosoma cruzi	DNA/RNA non-specific endonuclease protein-like, putative	0.0013	0.0936	0.225
Plasmodium falciparum	glutathione reductase	0.001	0.0676	0.2121
Echinococcus multilocularis	lipoxygenase domain containing protein	0.0012	0.0907	0.2693
Trypanosoma brucei	dihydrolipoamide dehydrogenase	0.001	0.0676	0.1618
Echinococcus granulosus	ectonucleotide pyrophosphatase:phosphodiesterase	0.0021	0.1864	0.5534
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0907	0.199
Plasmodium falciparum	nucleoside-diphosphatase, putative	0.0027	0.2563	0.9058
Echinococcus multilocularis	thioredoxin glutathione reductase	0.003	0.282	0.8369
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.001	0.0676	0.1618
Toxoplasma gondii	thioredoxin reductase	0.003	0.282	0.6824
Loa Loa (eye worm)	hypothetical protein	0.001	0.0621	0.1362
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.0021	0.1864	0.5534
Brugia malayi	cytochrome P450	0.0004	0.001	0.0022
Toxoplasma gondii	ATP-dependent DNA helicase, RecQ family protein	0.0008	0.0445	0.1058
Loa Loa (eye worm)	RecQ helicase	0.0012	0.0895	0.1964
Schistosoma mansoni	polycystin 1-related	0.0012	0.0907	0.0907
Trypanosoma cruzi	nucleoside phosphatase, putative	0.0042	0.4127	1
Trichomonas vaginalis	mercuric reductase, putative	0.001	0.0676	0.2638
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.001	0.0676	0.1618
Toxoplasma gondii	peptidylprolyl isomerase	0.0021	0.1802	0.4353
Echinococcus multilocularis	ectonucleoside triphosphate diphosphohydrolase	0.0027	0.2563	0.7608
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.001	0.0676	0.1618
Echinococcus multilocularis	ectonucleotide	0.0018	0.1499	0.4448
Onchocerca volvulus		0.0021	0.1864	0.2622
Schistosoma mansoni	ectonucleotide pyrophosphatase/phosphodiesterase	0.0021	0.1864	0.1864
Echinococcus granulosus	Endonuclease G	0.0013	0.0936	0.2779
Brugia malayi	Cytochrome P450 family protein	0.0015	0.1222	0.2682
Loa Loa (eye worm)	hypothetical protein	0.0027	0.2563	0.5624
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.0021	0.1864	0.5534
Plasmodium vivax	thioredoxin reductase, putative	0.003	0.282	1
Trypanosoma cruzi	dihydrolipoyl dehydrogenase, putative	0.001	0.0676	0.1618
Wolbachia endosymbiont of Brugia malayi	dihydrolipoamide dehydrogenase E3 component	0.001	0.0676	1
Trypanosoma cruzi	endonuclease G, putative	0.0013	0.0936	0.225
Trichomonas vaginalis	adenosine diphosphatase, putative	0.0027	0.2563	1
Trypanosoma cruzi	nucleoside phosphatase, putative	0.0027	0.2563	0.6202
Brugia malayi	ATP-dependent DNA helicase, RecQ family protein	0.0005	0.0099	0.0218
Toxoplasma gondii	ATP-dependent DNA helicase, RecQ family protein	0.0005	0.0099	0.0217
Mycobacterium tuberculosis	Probable membrane NADH dehydrogenase NdhA	0.0068	0.7022	0.8936
Toxoplasma gondii	GDA1/CD39 (nucleoside phosphatase) family protein	0.0042	0.4127	1
Schistosoma mansoni	ATP-diphosphohydrolase 1	0.0027	0.2563	0.2563
Plasmodium falciparum	thioredoxin reductase	0.001	0.0676	0.2121
Trypanosoma cruzi	peptidyl-prolyl cis-trans isomerase, putative	0.0006	0.0244	0.0569
Echinococcus granulosus	lipoxygenase domain containing protein	0.0012	0.0907	0.2693
Loa Loa (eye worm)	cytochrome P450 family protein	0.0004	0.001	0.0022
Echinococcus granulosus	ectonucleoside triphosphate diphosphohydrolase	0.0027	0.2563	0.7608
Plasmodium falciparum	dihydrolipoyl dehydrogenase, mitochondrial	0.001	0.0676	0.2121
Loa Loa (eye worm)	hypothetical protein	0.0005	0.0099	0.0218
Trypanosoma brucei	ATP-dependent DEAD/H DNA helicase recQ, putative	0.0007	0.0264	0.0617
Schistosoma mansoni	DNA helicase recq1	0.0005	0.0099	0.0099
Trypanosoma cruzi	peptidyl-prolyl cis-trans isomerase	0.0006	0.0244	0.0569
Giardia lamblia	NADH oxidase lateral transfer candidate	0.001	0.0676	1
Trichomonas vaginalis	adenosine diphosphatase, putative	0.0027	0.2563	1
Schistosoma mansoni	rab6-interacting	0.0012	0.0907	0.0907
Loa Loa (eye worm)	thrombospondin type 1 domain-containing protein	0.0046	0.4558	1
Echinococcus granulosus	ectonucleotide	0.0018	0.1499	0.4448
Leishmania major	ATP-dependent DEAD/H DNA helicase recQ, putative	0.0007	0.0264	0.0617
Entamoeba histolytica	recQ family helicase, putative	0.0007	0.0264	0.1465
Brugia malayi	glutathione reductase	0.003	0.282	0.6186
Schistosoma mansoni	lipoxygenase	0.0035	0.3369	0.3369
Trypanosoma cruzi	peptidyl-prolyl cis-trans isomerase	0.0021	0.1802	0.4353
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.0018	0.1499	0.4448
Toxoplasma gondii	NADPH-glutathione reductase	0.001	0.0676	0.1618
Echinococcus multilocularis	ectonucleoside triphosphate diphosphohydrolase	0.0027	0.2563	0.7608
Mycobacterium tuberculosis	Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras	0.0076	0.7857	1
Trypanosoma brucei	peptidyl-prolyl cis-trans isomerase/rotamase, putative	0.0021	0.1802	0.4353
Schistosoma mansoni	lipoxygenase	0.0012	0.0907	0.0907
Mycobacterium ulcerans	flavoprotein disulfide reductase	0.001	0.0676	1
Leishmania major	ATP diphosphohydrolase	0.0042	0.4127	1
Leishmania major	nucleoside phosphatase, putative,guanosine diphosphatase, putative	0.0042	0.4127	1
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0907	0.199
Toxoplasma gondii	PPIC-type PPIASE domain-containing protein	0.0006	0.0244	0.0569
Loa Loa (eye worm)	Pin1-type peptidyl-prolyl cis-trans isomerase	0.0021	0.1857	0.4073
Echinococcus multilocularis	RUN	0.0012	0.0907	0.2693
Toxoplasma gondii	ATP-dependent DNA helicase, RecQ family protein	0.0005	0.0099	0.0217
Schistosoma mansoni	hypothetical protein	0.0004	0.001	0.001
Chlamydia trachomatis	dihydrolipoyl dehydrogenase	0.001	0.0676	0.5
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.0021	0.1864	0.5534
Trypanosoma brucei	dihydrolipoyl dehydrogenase	0.001	0.0676	0.1618
Leishmania major	peptidyl-prolyl cis-trans isomerase/rotamase, putative,PPIase, putative	0.0021	0.1802	0.4353
Echinococcus multilocularis		0.0004	0.001	0.0029
Brugia malayi	endonuclease G, mitochondrial precursor	0.0013	0.0936	0.2054
Mycobacterium tuberculosis	NAD(P)H quinone reductase LpdA	0.0076	0.7857	1
Echinococcus multilocularis	dihydrolipoamide dehydrogenase	0.001	0.0676	0.2007
Loa Loa (eye worm)	cytochrome P450	0.0004	0.001	0.0022
Echinococcus multilocularis	Polycystic kidney disease protein	0.0012	0.0907	0.2693
Brugia malayi	Doublecortin family protein	0.0012	0.0907	0.199
Trichomonas vaginalis	adenosine diphosphatase, putative	0.0027	0.2563	1
Mycobacterium tuberculosis	Probable oxidoreductase	0.0076	0.7857	1
Trypanosoma cruzi	endonuclease G, putative	0.0013	0.0936	0.225
Brugia malayi	Pyridine nucleotide-disulphide oxidoreductase, dimerisation domain containing protein	0.0008	0.0375	0.0822
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.0021	0.1864	0.5534
Loa Loa (eye worm)	hypothetical protein	0.0021	0.1864	0.409
Plasmodium falciparum	glutathione reductase	0.003	0.282	1
Schistosoma mansoni	hypothetical protein	0.0046	0.4558	0.4558
Mycobacterium tuberculosis	Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB	0.0068	0.7022	0.8936
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.001	0.0676	0.1618
Brugia malayi	hypothetical protein	0.0012	0.0907	0.199
Brugia malayi	Cytochrome P450 family protein	0.0004	0.001	0.0022
Echinococcus granulosus	ectonucleotide pyrophosphatase:phosphodiesterase	0.0021	0.1864	0.5534
Trypanosoma cruzi	dihydrolipoyl dehydrogenase, putative	0.001	0.0676	0.1618
Schistosoma mansoni	guanosine-diphosphatase	0.0027	0.2563	0.2563
Trypanosoma cruzi	ATP-dependent DEAD/H DNA helicase recQ, putative	0.0007	0.0264	0.0617
Schistosoma mansoni	dihydrolipoamide dehydrogenase	0.001	0.0676	0.0676
Echinococcus granulosus	lipoxygenase domain containing protein	0.0012	0.0907	0.2693
Plasmodium vivax	multidomain scavenger receptor, putative	0.0012	0.0907	0.1908
Toxoplasma gondii	Nucleoside-diphosphatase	0.0027	0.2563	0.6202
Echinococcus granulosus	ectonucleotide pyrophosphatase:phosphodiesterase	0.0018	0.1499	0.4448
Trypanosoma brucei	nucleoside diphosphatase, putative	0.0042	0.4127	1
Loa Loa (eye worm)	doublecortin family protein	0.0012	0.0907	0.199
Toxoplasma gondii	DNA/RNA non-specific endonuclease	0.0013	0.0936	0.225
Onchocerca volvulus		0.0021	0.1864	0.2622
Echinococcus multilocularis	ATP dependent DNA helicase Q1	0.0005	0.0099	0.0295
Trichomonas vaginalis	guanosine-diphosphatase, putative	0.0027	0.2563	1
Trichomonas vaginalis	conserved hypothetical protein	0.0027	0.2563	1
Schistosoma mansoni	ectonucleotide pyrophosphatase/phosphodiesterase	0.0021	0.1864	0.1864
Echinococcus granulosus	bloom syndrome protein	0.0012	0.0895	0.2658
Brugia malayi	Nucleoside-diphosphatase mig-23	0.0027	0.2563	0.5624
Brugia malayi	Type I phosphodiesterase / nucleotide pyrophosphatase family protein	0.0021	0.1864	0.409
Trypanosoma brucei	endonuclease G, putative	0.0013	0.0936	0.225
Loa Loa (eye worm)	glutathione reductase	0.003	0.282	0.6186
Trypanosoma cruzi	peptidyl-prolyl cis-trans isomerase	0.0021	0.1802	0.4353
Trichomonas vaginalis	glutathione reductase, putative	0.001	0.0676	0.2638
Echinococcus granulosus	arachidonate 5 lipoxygenase	0.0035	0.3369	1
Entamoeba histolytica	peptidyl-prolyl cis-trans isomerase, putative	0.0021	0.1802	1
Schistosoma mansoni	guanosine-diphosphatase	0.0027	0.2563	0.2563
Trichomonas vaginalis	rotamase, putative	0.0021	0.1802	0.703
Trypanosoma cruzi	trypanothione reductase, putative	0.001	0.0676	0.1618
Trichomonas vaginalis	conserved hypothetical protein	0.0027	0.2563	1
Schistosoma mansoni	rab6-interacting	0.0012	0.0907	0.0907
Toxoplasma gondii	GDA1/CD39 (nucleoside phosphatase) family protein	0.0027	0.2563	0.6202
Trypanosoma brucei	endonuclease G, putative	0.0013	0.0936	0.225
Wolbachia endosymbiont of Brugia malayi	dihydrolipoamide dehydrogenase E3 component	0.001	0.0676	1
Echinococcus multilocularis	bloom syndrome protein	0.0012	0.0895	0.2658
Echinococcus granulosus	ATP dependent DNA helicase Q1	0.0005	0.0099	0.0295
Onchocerca volvulus		0.0046	0.4558	1
Leishmania major	2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein	0.001	0.0676	0.1618
Echinococcus granulosus	ectonucleotide pyrophosphatase:phosphodiesterase	0.0021	0.1864	0.5534
Schistosoma mansoni	ectonucleotide pyrophosphatase/phosphodiesterase	0.0021	0.1864	0.1864
Mycobacterium leprae	DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE	0.0076	0.7857	1
Plasmodium vivax	dihydrolipoyl dehydrogenase, mitochondrial, putative	0.001	0.0676	0.093
Loa Loa (eye worm)	CYP4Cod1	0.0004	0.001	0.0022
Plasmodium falciparum	ADP-dependent DNA helicase RecQ	0.0011	0.0731	0.2321
Plasmodium falciparum	LCCL domain-containing protein	0.0012	0.0907	0.297
Echinococcus granulosus	dihydrolipoamide dehydrogenase	0.001	0.0676	0.2007
Mycobacterium leprae	PROBABLE NADH DEHYDROGENASE NDH	0.0068	0.7022	0.8936
Toxoplasma gondii	pyruvate dehydrogenase complex subunit PDH-E3II	0.001	0.0676	0.1618
Brugia malayi	dihydrolipoyl dehydrogenase, mitochondrial precursor, putative	0.001	0.0676	0.1484
Trichomonas vaginalis	rotamase, putative	0.0021	0.1857	0.7243
Leishmania major	trypanothione reductase	0.003	0.282	0.6824
Trypanosoma brucei	endonuclease G, putative	0.0013	0.0936	0.225
Echinococcus multilocularis	arachidonate 5 lipoxygenase	0.0035	0.3369	1
Echinococcus granulosus	thioredoxin glutathione reductase	0.003	0.282	0.8369
Trypanosoma brucei	dihydrolipoamide dehydrogenase	0.001	0.0676	0.1618
Echinococcus granulosus	expressed protein	0.0021	0.1857	0.551
Plasmodium vivax	dihydrolipoyl dehydrogenase, apicoplast, putative	0.001	0.0676	0.093
Mycobacterium tuberculosis	Probable NADH dehydrogenase Ndh	0.0068	0.7022	0.8936
Echinococcus granulosus	RUN	0.0012	0.0907	0.2693
Plasmodium falciparum	thioredoxin reductase	0.003	0.282	1
Leishmania major	dihydrolipoamide dehydrogenase, putative	0.001	0.0676	0.1618
Brugia malayi	Bloom's syndrome protein homolog	0.0012	0.0895	0.1964
Echinococcus granulosus	ectonucleotide pyrophosphatase:phosphodiesterase	0.0021	0.1864	0.5534
Trichomonas vaginalis	guanosine-diphosphatase, putative	0.0027	0.2563	1
Schistosoma mansoni	cytochrome P450	0.0004	0.001	0.001
Trichomonas vaginalis	guanosine-diphosphatase, putative	0.0027	0.2563	1
Schistosoma mansoni	hypothetical protein	0.0012	0.0907	0.0907
Toxoplasma gondii	NTPase II	0.0027	0.2563	0.6202
Plasmodium falciparum	apyrase, putative	0.0027	0.2563	0.9058
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.001	0.0676	0.1618
Plasmodium vivax	nucleoside-diphosphatase mig-23, putative	0.0027	0.2563	0.8916
Brugia malayi	alpha keto acid dehydrogenase complex, E3 component, lipoamide dehydrogenase	0.0008	0.0375	0.0822
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.0021	0.1864	0.5534
Schistosoma mansoni	adenosine diphosphatase	0.0042	0.4127	0.4127
Schistosoma mansoni	rotamase	0.0021	0.1857	0.1857
Mycobacterium ulcerans	dihydrolipoamide dehydrogenase	0.001	0.0676	1
Trichomonas vaginalis	adenosine/guanosine diphosphatase, putative	0.0027	0.2563	1
Echinococcus granulosus	ectonucleotide pyrophosphatase:phosphodiesterase	0.0021	0.1864	0.5534
Trypanosoma brucei	dihydrolipoamide dehydrogenase, point mutation	0.001	0.0676	0.1618
Trichomonas vaginalis	DNA helicase recq1, putative	0.0012	0.0895	0.3493
Schistosoma mansoni	blooms syndrome DNA helicase	0.001	0.061	0.061
Echinococcus granulosus	Polycystic kidney disease protein	0.0012	0.0907	0.2693
Leishmania major	acetoin dehydrogenase e3 component-like protein	0.001	0.0676	0.1618
Plasmodium vivax	glutathione reductase, putative	0.003	0.282	1
Trypanosoma brucei	nucleoside phosphatase, putative	0.0042	0.4127	1
Leishmania major	DNA/RNA non-specific endonuclease-like protein	0.0013	0.0936	0.225
Loa Loa (eye worm)	thioredoxin reductase	0.003	0.282	0.6186
Leishmania major	dihydrolipoamide dehydrogenase, putative	0.001	0.0676	0.1618
Schistosoma mansoni	DNA helicase recq5	0.0005	0.0099	0.0099
Schistosoma mansoni	ectonucleotide pyrophosphatase/phosphodiesterase	0.0021	0.1864	0.1864
Trypanosoma cruzi	DNA/RNA non-specific endonuclease protein-like, putative	0.0013	0.0936	0.225
Brugia malayi	Thioredoxin reductase	0.003	0.282	0.6186
Loa Loa (eye worm)	hypothetical protein	0.0021	0.1864	0.409
Mycobacterium tuberculosis	NADPH-dependent mycothiol reductase Mtr	0.003	0.282	0.3581
Mycobacterium tuberculosis	Putative ferredoxin reductase	0.0068	0.7022	0.8936
Brugia malayi	hypothetical protein	0.0012	0.0907	0.199
Echinococcus granulosus	ectonucleoside triphosphate diphosphohydrolase	0.0027	0.2563	0.7608
Trypanosoma cruzi	trypanothione reductase, putative	0.003	0.282	0.6824
Brugia malayi	Pin1-type peptidyl-prolyl cis-trans isomerase, BmPin1	0.0021	0.1857	0.4073
Echinococcus multilocularis	ectonucleoside triphosphate diphosphohydrolase	0.0027	0.2563	0.7608
Mycobacterium tuberculosis	Probable dehydrogenase	0.0068	0.7022	0.8936
Echinococcus granulosus	ATP dependent DNA helicase Q5	0.0005	0.0099	0.0295
Loa Loa (eye worm)	ATP-dependent DNA helicase	0.0005	0.0099	0.0218
Echinococcus multilocularis	lipoxygenase domain containing protein	0.0012	0.0907	0.2693
Trypanosoma brucei	peptidyl-prolyl cis-trans isomerase, putative	0.0006	0.0244	0.0569
Trichomonas vaginalis	conserved hypothetical protein	0.0021	0.1857	0.7243
Mycobacterium tuberculosis	Probable soluble pyridine nucleotide transhydrogenase SthA (STH) (NAD(P)(+) transhydrogenase [B-specific]) (nicotinamide nucleot	0.001	0.0676	0.0849
Echinococcus granulosus	3'partial\|ectonucleoside triphosphate diphosphohydrolase	0.0027	0.2563	0.7608
Loa Loa (eye worm)	cytochrome P450 family protein	0.0015	0.1222	0.2682
Loa Loa (eye worm)	hypothetical protein	0.0021	0.1864	0.409
Trichomonas vaginalis	DNA helicase recq, putative	0.0012	0.0895	0.3493
Loa Loa (eye worm)	hypothetical protein	0.0018	0.1499	0.3288
Schistosoma mansoni	loxhd1	0.0012	0.0907	0.0907
Trichomonas vaginalis	adenosine diphosphatase, putative	0.0027	0.2563	1
Trypanosoma brucei	trypanothione reductase	0.003	0.282	0.6824
Plasmodium falciparum	dihydrolipoyl dehydrogenase, apicoplast	0.001	0.0676	0.2121
Leishmania major	endonuclease G, putative	0.0013	0.0936	0.225
Treponema pallidum	NADH oxidase	0.001	0.0676	0.5
Brugia malayi	ATP-dependent DNA helicase, RecQ family protein	0.0005	0.0099	0.0218
Echinococcus multilocularis	ATP dependent DNA helicase Q5	0.0005	0.0099	0.0295
Echinococcus multilocularis	expressed protein	0.0021	0.1857	0.551
Leishmania major	peptidyl-prolyl cis-trans isomerase, putative	0.0006	0.0244	0.0569

Activities

Activity type	Activity value	Assay description	Source	Reference
Activity (functional)	= 40 %	Ex vivo antithrombotic activity in mouse assessed as protection against collagen and adrenaline-induced hind limb paralysis or death at 30 uM/kg, po administered 60 mins prior to thrombotic challenge after 1 hr	ChEMBL.	22004722
Activity (functional)	= 44 %	Ex vivo antithrombotic activity in mouse assessed as protection against collagen and adrenaline-induced hind limb paralysis or death at 30 uM/kg, po administered 60 mins prior to thrombotic challenge after 3 days	ChEMBL.	22004722
Activity (ADMET)	= 84 %	Toxicity in mouse assessed as increase in bleeding time at 30 uM/kg, po administered 60 mins prior to tail incision after 1 hr relative to aspirin	ChEMBL.	22004722
Activity (ADMET)	= 109 %	Toxicity in mouse assessed as increase in bleeding time at 30 uM/kg, po administered 60 mins prior to tail incision after 3 days relative to aspirin	ChEMBL.	22004722
Time (functional)	= 10.6 min	Ex vivo anticoagulant activity in mouse assessed as prothrombin time in plasma at 30 uM/kg, po after for 3 days	ChEMBL.	22004722

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: CHEMBL1923407

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1569156