TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 465.5 | Formula: C23H20FN5O3S
H donors: 1 H acceptors: 5 LogP: 2.76 Rotable bonds: 9
Rule of 5 violations (Lipinski): 1
SMILES: Fc1cccc(c1)/C=C/S(=O)(=O)Nc1cccc(c1)OCc1nnn(c1)Cc1cccnc1
InChi: 1S/C23H20FN5O3S/c24-20-6-1-4-18(12-20)9-11-33(30,31)27-21-7-2-8-23(13-21)32-17-22-16-29(28-26-22)15-19-5-3-10-25-14-19/h1-14,16,27H,15,17H2/b11-9+
InChiKey: SZPYBQSMUOZZMZ-PKNBQFBNSA-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
Leishmania major	cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like	0.0053	0.1112	0.1097
Brugia malayi	Cathepsin L-like precursor	0.0048	0.0975	0.0975
Leishmania major	4-coumarate:coa ligase-like protein	0.0023	0.0238	0.0221
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0034	0.0552	0.4382
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0048	0.0975	0.8624
Entamoeba histolytica	cysteine proteinase, putative	0.0048	0.0975	1
Schistosoma mansoni	hypothetical protein	0.0026	0.0313	0.0728
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0048	0.0975	0.8624
Brugia malayi	Cathepsin L-like cysteine proteinase	0.0034	0.0552	0.0552
Entamoeba histolytica	cysteine protease, putative	0.0027	0.0354	0.2786
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0045	0.0863	0.1975
Schistosoma mansoni	cercarial elastase (S01 family)	0.0026	0.0313	0.0728
Schistosoma mansoni	tar DNA-binding protein	0.0061	0.1342	0.3122
Onchocerca volvulus		0.0048	0.0975	1
Plasmodium vivax	ataxin-2 like protein, putative	0.0025	0.0285	0.2926
Schistosoma mansoni	cercarial elastase (S01 family)	0.0026	0.0313	0.0728
Entamoeba histolytica	cysteine protease, putative	0.0027	0.0354	0.2786
Onchocerca volvulus	Deterin homolog	0.004	0.073	0.6673
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0115	0.0098
Mycobacterium ulcerans	acyl-CoA synthetase	0.0023	0.0238	0.6883
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0048	0.0975	0.096
Entamoeba histolytica	cysteine protease, putative	0.0027	0.0354	0.2786
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0313	0.0313
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0026	0.0313	0.0728
Schistosoma mansoni	aminopeptidase PILS (M01 family)	0.0026	0.0313	0.0728
Trypanosoma brucei	DNA polymerase IV, putative	0.0019	0.0115	0.0098
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0045	0.0863	0.0863
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0115	0.0098
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0238	0.0238
Echinococcus multilocularis	glycoprotein Antigen 5	0.0026	0.0313	0.0693
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0048	0.0975	0.8624
Loa Loa (eye worm)	ctsf protein	0.0048	0.0975	0.0975
Plasmodium vivax	vivapain-1	0.0027	0.0354	0.3634
Leishmania major	cathepsin L-like protease	0.0048	0.0975	0.096
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0048	0.0975	0.8624
Trypanosoma cruzi	cysteine peptidase (N-terminal), putative	0.0027	0.0354	0.0354
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0145	0.375	0.8722
Schistosoma mansoni	hypothetical protein	0.0033	0.0527	0.1225
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0048	0.0966	0.0966
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0026	0.0313	0.0728
Echinococcus granulosus	cathepsin l1	0.0034	0.0552	0.125
Mycobacterium ulcerans	acyl-CoA synthetase	0.0023	0.0238	0.6883
Entamoeba histolytica	cysteine protease, putative	0.0027	0.0354	0.2786
Giardia lamblia	Cathepsin B precursor	0.0053	0.1112	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0115	0.0098
Brugia malayi	RNA binding protein	0.0061	0.1342	0.1342
Trypanosoma brucei	C-8 sterol isomerase, putative	0.0361	1	1
Schistosoma mansoni	cercarial elastase (S01 family)	0.0026	0.0313	0.0728
Schistosoma mansoni	tar DNA-binding protein	0.0061	0.1342	0.3122
Plasmodium falciparum	cysteine proteinase falcipain 1	0.0027	0.0354	0.352
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0071	0.0071
Echinococcus multilocularis	Mastin	0.0026	0.0313	0.0693
Brugia malayi	Papain family cysteine protease containing protein	0.0027	0.0354	0.0354
Schistosoma mansoni	hypothetical protein	0.0015	0.0016	0.0038
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0027	0.0354	0.0824
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0015	0.0016	0.0016
Trypanosoma cruzi	cysteine peptidase, putative	0.0048	0.0975	0.0975
Loa Loa (eye worm)	hypothetical protein	0.0048	0.0975	0.0975
Onchocerca volvulus		0.0048	0.0975	1
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0019	0.0115	0.0115
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0048	0.0975	0.8624
Echinococcus multilocularis	isocitrate dehydrogenase 2 (NADP+)	0.0015	0.0017	0.0002
Brugia malayi	ImpB/MucB/SamB family protein	0.0019	0.0115	0.0115
Entamoeba histolytica	cysteine protease, putative	0.0027	0.0354	0.2786
Echinococcus granulosus	subfamily S1A unassigned peptidase S01 family	0.0026	0.0313	0.0693
Plasmodium falciparum	cysteine proteinase falcipain 3	0.0048	0.0975	1
Echinococcus granulosus	cathepsin b	0.0145	0.375	0.8717
Echinococcus multilocularis	cathepsin L	0.0027	0.0354	0.0789
Entamoeba histolytica	cysteine proteinase, putative	0.0027	0.0354	0.2786
Echinococcus granulosus	transmembrane protease serine 3	0.0026	0.0313	0.0693
Entamoeba histolytica	cysteine proteinase, putative	0.0034	0.0552	0.5081
Brugia malayi	hypothetical protein	0.0025	0.0285	0.0285
Schistosoma mansoni	hypothetical protein	0.0026	0.0313	0.0728
Entamoeba histolytica	cysteine proteinase, putative	0.0027	0.0354	0.2786
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0145	0.375	0.8722
Entamoeba histolytica	cysteine proteinase, putative	0.0027	0.0354	0.2786
Echinococcus granulosus	terminal deoxycytidyl transferase rev1	0.0019	0.0115	0.0229
Trypanosoma brucei	DNA polymerase IV, putative	0.0019	0.0115	0.0098
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0313	0.0313
Entamoeba histolytica	cysteine proteinase, putative	0.0027	0.0354	0.2786
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0048	0.0975	0.8624
Echinococcus multilocularis	cysteine protease	0.0048	0.0975	0.2238
Trypanosoma cruzi	cysteine peptidase, putative	0.0048	0.0975	0.0975
Onchocerca volvulus		0.0048	0.0975	1
Echinococcus multilocularis	isocitrate dehydrogenase	0.0015	0.0017	0.0002
Echinococcus multilocularis	inhibitor of apoptosis protein	0.004	0.073	0.1665
Plasmodium falciparum	ataxin-2 like protein, putative	0.0025	0.0285	0.28
Mycobacterium ulcerans	long-chain fatty-acid CoA ligase	0.0023	0.0238	0.6883
Schistosoma mansoni	NADP-specific isocitrate dehydrogenase	0.0015	0.0017	0.004
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0048	0.0975	0.8624
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0045	0.0863	0.1975
Trypanosoma cruzi	isocitrate dehydrogenase, putative	0.0015	0.0017	0.0017
Echinococcus granulosus	cathepsin L	0.0027	0.0354	0.0789
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.0863	0.2006
Brugia malayi	cathepsin L-like precursor	0.0034	0.0552	0.0552
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0026	0.0313	0.0728
Loa Loa (eye worm)	TAR-binding protein	0.0061	0.1342	0.1342
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0016	0.0044	0.1199
Trypanosoma brucei	PAB1-binding protein , putative	0.0025	0.0285	0.0269
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.0034	0.0552	0.0552
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0552	0.0552
Echinococcus granulosus	enteropeptidase	0.0026	0.0313	0.0693
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0016	0.0044	0.1199
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0023	0.0238	0.5
Loa Loa (eye worm)	cysteine protease	0.0048	0.0975	0.0975
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0045	0.0863	0.0863
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0115	0.0098
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0019	0.0115	0.4425
Brugia malayi	Cell death protein 3 precursor	0.003	0.0454	0.0454
Plasmodium vivax	vivapain-3	0.0027	0.0354	0.3634
Schistosoma mansoni	terminal deoxycytidyl transferase	0.0019	0.0115	0.0267
Onchocerca volvulus		0.0048	0.0975	1
Giardia lamblia	Cathepsin B precursor	0.0053	0.1112	1
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0313	0.0313
Schistosoma mansoni	inhibitor of apoptosis (iap) domain family member	0.004	0.073	0.1697
Schistosoma mansoni	cercarial elastase (S01 family)	0.0026	0.0313	0.0728
Echinococcus multilocularis	transmembrane protease serine 3	0.0026	0.0313	0.0693
Loa Loa (eye worm)	hypothetical protein	0.0048	0.0966	0.0966
Plasmodium vivax	acyl-CoA synthetase, putative	0.0017	0.0071	0.0723
Schistosoma mansoni	tar DNA-binding protein	0.0061	0.1342	0.3122
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0048	0.0975	0.8624
Echinococcus multilocularis	enteropeptidase	0.0026	0.0313	0.0693
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0048	0.0975	0.8624
Schistosoma mansoni	tar DNA-binding protein	0.0061	0.1342	0.3122
Trypanosoma cruzi	cysteine protease, putative	0.0027	0.0354	0.0354
Schistosoma mansoni	cercarial elastase (S01 family)	0.0026	0.0313	0.0728
Echinococcus multilocularis	geminin	0.0164	0.43	1
Mycobacterium tuberculosis	Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed))	0.0019	0.0115	0.4425
Echinococcus granulosus	baculoviral IAP repeat containing protein	0.004	0.073	0.1665
Loa Loa (eye worm)	hypothetical protein	0.003	0.0454	0.0454
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0048	0.0975	0.8624
Schistosoma mansoni	cercarial elastase (S01 family)	0.0026	0.0313	0.0728
Schistosoma mansoni	cathepsin F (C01 family)	0.0034	0.0552	0.1283
Schistosoma mansoni	hypothetical protein	0.0015	0.0016	0.0038
Trypanosoma brucei	DNA polymerase eta, putative	0.0019	0.0115	0.0098
Onchocerca volvulus	Cathepsin F homolog	0.0048	0.0975	1
Echinococcus granulosus	cysteine protease	0.0027	0.0354	0.0789
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0048	0.0975	0.8624
Echinococcus granulosus	NADP dependent isocitrate dehydrogenase	0.0015	0.0017	0.0002
Leishmania major	4-coumarate:coa ligase-like protein	0.0023	0.0238	0.0221
Entamoeba histolytica	cysteine proteinase, putative	0.0048	0.0975	1
Entamoeba histolytica	cysteine proteinase 1, putative	0.0027	0.0354	0.2786
Echinococcus multilocularis	terminal deoxycytidyl transferase rev1	0.0019	0.0115	0.0229
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0048	0.0975	0.8624
Onchocerca volvulus	Cell death protein 3 homolog	0.003	0.0454	0.294
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0313	0.0313
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0015	0.0016	0.0016
Brugia malayi	AMP-binding enzyme family protein	0.0023	0.0238	0.0238
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0115	0.0098
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.0048	0.0975	0.0975
Schistosoma mansoni	hypothetical protein	0.0015	0.0016	0.0038
Schistosoma mansoni	cercarial elastase (S01 family)	0.0026	0.0313	0.0728
Schistosoma mansoni	DNA polymerase eta	0.0019	0.0115	0.0267
Plasmodium falciparum	acyl-CoA synthetase	0.0017	0.0071	0.0557
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0048	0.0975	0.2238
Echinococcus multilocularis	cathepsin b	0.0145	0.375	0.8717
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0015	0.0017	0.0002
Onchocerca volvulus		0.0026	0.0313	0.1026
Onchocerca volvulus	Cathepsin L homolog	0.0048	0.0975	1
Plasmodium vivax	isocitrate dehydrogenase [NADP], mitochondrial, putative	0.0015	0.0017	0.0176
Brugia malayi	Isocitrate dehydrogenase	0.0015	0.0017	0.0017
Trypanosoma brucei	DNA polymerase IV, putative	0.0019	0.0115	0.0098
Mycobacterium ulcerans	DNA polymerase IV	0.0019	0.0115	0.1819
Schistosoma mansoni	hypothetical protein	0.0164	0.43	1
Mycobacterium ulcerans	hypothetical protein	0.0026	0.0313	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0115	0.0098
Schistosoma mansoni	inhibitor of apoptosis protein	0.004	0.073	0.1697
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0023	0.0238	0.1429
Echinococcus multilocularis	cysteine protease	0.0048	0.0975	0.2238
Brugia malayi	Papain family cysteine protease containing protein	0.0027	0.0354	0.0354
Echinococcus granulosus	caspase 2	0.003	0.0454	0.1023
Onchocerca volvulus		0.0026	0.0313	0.1026
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0048	0.0975	0.8624
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0048	0.0975	0.096
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0026	0.0313	0.0728
Leishmania major	cathepsin L-like protease	0.0048	0.0975	0.096
Mycobacterium ulcerans	acyl-CoA synthetase	0.0023	0.0238	0.6883
Echinococcus granulosus	cathepsin l1	0.0048	0.0975	0.2238
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0048	0.0966	0.0966
Leishmania major	hypothetical protein, conserved	0.0025	0.0285	0.0269
Onchocerca volvulus	Cathepsin L homolog	0.0048	0.0975	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0048	0.0975	0.8624
Mycobacterium ulcerans	long-chain-fatty-acid-CoA ligase	0.0023	0.0238	0.6883
Echinococcus granulosus	Mastin	0.0026	0.0313	0.0693
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0048	0.0975	0.8624
Echinococcus granulosus	cathepsin b	0.0145	0.375	0.8717
Toxoplasma gondii	cathepsin CPL	0.0048	0.0975	0.8747
Entamoeba histolytica	cysteine protease, putative	0.0027	0.0354	0.2786
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0019	0.0115	0.0115
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0071	0.0071
Schistosoma mansoni	hypothetical protein	0.0164	0.43	1
Echinococcus granulosus	inhibitor of apoptosis protein	0.004	0.073	0.1665
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0048	0.0975	0.8624
Brugia malayi	Cathepsin L-like precursor	0.0048	0.0975	0.0975
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0048	0.0975	0.096
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0048	0.0975	0.096
Leishmania major	4-coumarate:coa ligase-like protein	0.0023	0.0238	0.0221
Trypanosoma cruzi	cysteine peptidase, putative	0.0048	0.0975	0.0975
Onchocerca volvulus		0.0026	0.0313	0.1026
Onchocerca volvulus		0.003	0.0454	0.294
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0313	0.0313
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0027	0.0354	0.2402
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0023	0.0238	0.6883
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0061	0.1342	0.1342
Leishmania major	C-8 sterol isomerase-like protein	0.0361	1	1
Echinococcus granulosus	cathepsin l cysteine peptidase	0.0048	0.0975	0.2238
Brugia malayi	Trypsin family protein	0.0026	0.0313	0.0313
Mycobacterium tuberculosis	Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase)	0.0023	0.0238	1
Trypanosoma brucei	unspecified product	0.0019	0.0115	0.0098
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0048	0.0975	0.8624
Echinococcus granulosus	cathepsin L cysteine protease	0.0027	0.0354	0.0789
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0048	0.0966	0.0966
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0045	0.0863	0.1975
Echinococcus granulosus	apoptotic protease activating factor 1	0.003	0.0454	0.1023
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.0048	0.0975	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0027	0.0354	0.2402
Echinococcus multilocularis	dna polymerase eta	0.0019	0.0115	0.0229
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0027	0.0354	0.0338
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0048	0.0975	0.8624
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0048	0.0975	0.096
Entamoeba histolytica	cysteine protease, putative	0.0048	0.0975	1
Giardia lamblia	Cathepsin B precursor	0.0053	0.1112	1
Loa Loa (eye worm)	hypothetical protein	0.004	0.073	0.073
Brugia malayi	Chymotrypsin-like protease CTRL-1 precursor	0.0026	0.0313	0.0313
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0019	0.0115	0.0115
Echinococcus multilocularis	caspase 2	0.003	0.0454	0.1023
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0048	0.0975	0.8624
Brugia malayi	ImpB/MucB/SamB family protein	0.0019	0.0115	0.0115
Loa Loa (eye worm)	hypothetical protein	0.0185	0.4904	0.4904
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0048	0.0975	0.0975
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0048	0.0975	0.8624
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0048	0.0975	0.8624
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0048	0.0975	0.8624
Echinococcus granulosus	glycoprotein Antigen 5	0.0026	0.0313	0.0693
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0048	0.0975	0.096
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0048	0.0975	0.096
Plasmodium vivax	unspecified product	0.0027	0.0354	0.3634
Schistosoma mansoni	cercarial elastase (S01 family)	0.0026	0.0313	0.0728
Echinococcus multilocularis	cathepsin L cysteine protease	0.0048	0.0975	0.2238
Echinococcus multilocularis	Peptidase S1 S6, chymotrypsin Hap	0.0026	0.0313	0.0693
Onchocerca volvulus		0.0048	0.0975	1
Loa Loa (eye worm)	cathepsin B	0.0053	0.1112	0.1112
Loa Loa (eye worm)	hypothetical protein	0.0361	1	1
Leishmania major	cathepsin L-like protease	0.0048	0.0975	0.096
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0048	0.0975	0.2238
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0071	0.0071
Brugia malayi	hypothetical protein	0.0026	0.0313	0.0313
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0023	0.0238	0.1429
Entamoeba histolytica	cysteine protease, putative	0.0027	0.0354	0.2786
Schistosoma mansoni	hypothetical protein	0.004	0.073	0.1697
Echinococcus multilocularis	tar DNA binding protein	0.0061	0.1342	0.3096
Trypanosoma cruzi	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.0015	0.0017	0.0017
Loa Loa (eye worm)	trypsin family protein	0.0026	0.0313	0.0313
Mycobacterium ulcerans	DNA polymerase IV	0.0019	0.0115	0.1819
Schistosoma mansoni	tar DNA-binding protein	0.0061	0.1342	0.3122
Loa Loa (eye worm)	fibroinase	0.0048	0.0975	0.0975
Brugia malayi	RNA recognition motif domain containing protein	0.0061	0.1342	0.1342
Loa Loa (eye worm)	ImpB/MucB/SamB family protein	0.0019	0.0115	0.0115
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.0048	0.0975	1
Brugia malayi	hypothetical protein	0.003	0.0454	0.0454
Brugia malayi	Cathepsin L-like precursor	0.0048	0.0975	0.0975
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.0145	0.375	0.375
Entamoeba histolytica	cysteine protease, putative	0.0027	0.0354	0.2786
Schistosoma mansoni	cercarial elastase (S01 family)	0.0026	0.0313	0.0728
Echinococcus multilocularis	cathepsin L cysteine protease	0.0048	0.0975	0.2238
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0071	0.0071
Leishmania major	DNA polymerase kappa, putative,DNA polymerase IV, putative	0.0019	0.0115	0.0098
Brugia malayi	Papain family cysteine protease containing protein	0.0048	0.0975	0.0975
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.0863	0.2006
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0238	0.0238
Onchocerca volvulus		0.0026	0.0313	0.1026
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0015	0.0017	0.0002
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0115	0.0098
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0145	0.375	0.8722
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0048	0.0975	0.8624
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0053	0.1112	1
Trypanosoma cruzi	cysteine peptidase, putative	0.0048	0.0975	0.0975
Schistosoma mansoni	cathepsin F (C01 family)	0.0048	0.0975	0.2268
Schistosoma mansoni	cercarial elastase (S01 family)	0.0026	0.0313	0.0728
Brugia malayi	hypothetical protein	0.0016	0.0034	0.0034
Echinococcus granulosus	dna polymerase kappa	0.0019	0.0115	0.0229
Brugia malayi	Inhibitor of Apoptosis domain containing protein	0.004	0.073	0.073
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0048	0.0975	0.096
Brugia malayi	AMP-binding enzyme family protein	0.0023	0.0238	0.0238
Schistosoma mansoni	caspase-7 (C14 family)	0.003	0.0454	0.1057
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0048	0.0975	0.8624
Onchocerca volvulus		0.0048	0.0975	1
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0238	0.0238
Mycobacterium ulcerans	long-chain-fatty-acid--CoA ligase	0.0023	0.0238	0.6883
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0313	0.0313
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0115	0.0098
Brugia malayi	Cathepsin L-like precursor	0.0048	0.0975	0.0975
Brugia malayi	Cathepsin L-like precursor	0.0034	0.0552	0.0552
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0071	0.0071
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0019	0.0115	0.0115
Onchocerca volvulus		0.0048	0.0975	1
Entamoeba histolytica	cysteine protease, putative	0.0027	0.0354	0.2786
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0115	0.0098
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0048	0.0975	0.8624
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0115	0.0115
Entamoeba histolytica	acyl-coA synthetase, putative	0.0023	0.0238	0.1429
Brugia malayi	cathepsin B-like cysteine proteinase	0.0145	0.375	0.375
Loa Loa (eye worm)	RNA binding protein	0.0061	0.1342	0.1342
Mycobacterium ulcerans	hypothetical protein	0.0023	0.0238	0.6883
Leishmania major	DNA polymerase kappa, putative	0.0019	0.0115	0.0098
Entamoeba histolytica	cysteine protease, putative	0.0027	0.0354	0.2786
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0023	0.0238	1
Echinococcus granulosus	tar DNA binding protein	0.0061	0.1342	0.3096
Toxoplasma gondii	LsmAD domain-containing protein	0.0025	0.0285	0.2449
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0115	0.0098
Chlamydia trachomatis	acylglycerophosphoethanolamine acyltransferase	0.0017	0.0071	0.5
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0048	0.0975	0.096
Plasmodium falciparum	ataxin-2 like protein, putative	0.0025	0.0285	0.28
Trypanosoma cruzi	PAB1-binding protein , putative	0.0025	0.0285	0.0285
Echinococcus multilocularis	subfamily S1A unassigned peptidase (S01 family)	0.0026	0.0313	0.0693
Onchocerca volvulus		0.0034	0.0552	0.4261
Trypanosoma cruzi	DNA polymerase eta, putative	0.0019	0.0115	0.0115
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0027	0.0354	0.0338
Brugia malayi	Latrophilin receptor protein 2	0.0015	0.0016	0.0016
Leishmania major	cathepsin L-like protease	0.0048	0.0975	0.096
Mycobacterium tuberculosis	Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.0017	0.0071	0.2422
Trypanosoma cruzi	cruzipain precursor, putative	0.0048	0.0975	0.0975
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.0053	0.1112	0.1112
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0023	0.0238	0.5
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0026	0.0313	0.0728
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0027	0.0354	0.0824
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0026	0.0313	0.0728
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0016	0.0044	0.1199
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0527	0.0527
Plasmodium vivax	vivapain-2	0.0048	0.0975	1
Echinococcus granulosus	dna polymerase eta	0.0019	0.0115	0.0229
Brugia malayi	Cathepsin L-like precursor	0.0048	0.0975	0.0975
Leishmania major	cathepsin L-like protease	0.0048	0.0975	0.096
Loa Loa (eye worm)	isocitrate dehydrogenase	0.0015	0.0017	0.0017
Trypanosoma cruzi	cysteine proteinase, putative	0.0027	0.0354	0.0354
Entamoeba histolytica	cysteine protease, putative	0.0027	0.0354	0.2786
Schistosoma mansoni	rab geranylgeranyl transferase alpha subunit	0.0019	0.0115	0.0267
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0552	0.0552
Entamoeba histolytica	cysteine protease, putative	0.0027	0.0354	0.2786
Schistosoma mansoni	hypothetical protein	0.003	0.0454	0.1057
Entamoeba histolytica	cysteine protease, putative	0.0027	0.0354	0.2786
Brugia malayi	Trypsin family protein	0.0026	0.0313	0.0313
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0026	0.0313	0.0728
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0313	0.0313
Echinococcus granulosus	geminin	0.0164	0.43	1
Trypanosoma cruzi	PAB1-binding protein , putative	0.0025	0.0285	0.0285
Loa Loa (eye worm)	hypothetical protein	0.004	0.073	0.073
Leishmania major	DNA polymerase eta, putative	0.0019	0.0115	0.0098
Brugia malayi	isocitrate dehydrogenase	0.0015	0.0017	0.0017
Trypanosoma cruzi	cysteine peptidase, putative	0.0027	0.0354	0.0354
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0016	0.0016
Toxoplasma gondii	cathepsin B	0.0053	0.1112	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0048	0.0975	0.096
Echinococcus multilocularis	cathepsin b	0.0145	0.375	0.8717
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0048	0.0975	0.096
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0285	0.0285
Trypanosoma brucei	cysteine peptidase C (CPC)	0.0053	0.1112	0.1097
Schistosoma mansoni	hypothetical protein	0.0015	0.0016	0.0038
Leishmania major	cysteine peptidase A (CPA)	0.0048	0.0975	0.096
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0552	0.0552
Trypanosoma cruzi	cysteine proteinase, putative	0.0027	0.0354	0.0354
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0045	0.0863	0.1975
Echinococcus multilocularis	baculoviral IAP repeat containing protein	0.004	0.073	0.1665
Schistosoma mansoni	cathepsin F (C01 family)	0.0048	0.0975	0.2268
Leishmania major	cathepsin L-like protease	0.0048	0.0975	0.096
Plasmodium vivax	vivapain-2	0.0048	0.0975	1
Loa Loa (eye worm)	hypothetical protein	0.003	0.0454	0.0454
Echinococcus multilocularis	dna polymerase kappa	0.0019	0.0115	0.0229
Brugia malayi	AMP-binding enzyme family protein	0.0023	0.0238	0.0238
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0015	0.0017	0.0002
Onchocerca volvulus		0.0026	0.0313	0.1026
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0053	0.1112	0.2587
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0034	0.0552	0.4382
Entamoeba histolytica	cysteine proteinase 2	0.0027	0.0354	0.2786
Loa Loa (eye worm)	hypothetical protein	0.0145	0.375	0.375
Echinococcus granulosus	Peptidase S1 S6 chymotrypsin Hap	0.0026	0.0313	0.0693
Onchocerca volvulus		0.0026	0.0313	0.1026
Brugia malayi	Cathepsin L-like precursor	0.0048	0.0975	0.0975
Echinococcus multilocularis	apoptotic protease activating factor 1	0.003	0.0454	0.1023
Brugia malayi	Trypsin family protein	0.0026	0.0313	0.0313
Brugia malayi	Trypsin family protein	0.0026	0.0313	0.0313
Schistosoma mansoni	SmCB2 peptidase (C01 family)	0.0145	0.375	0.8722
Brugia malayi	latrophilin 2 splice variant baaae	0.0033	0.0527	0.0527
Trypanosoma cruzi	C-8 sterol isomerase, putative	0.0361	1	1
Brugia malayi	Trypsin-like protease protein 5	0.0026	0.0313	0.0313
Brugia malayi	Cathepsin L-like precursor	0.0034	0.0552	0.0552
Schistosoma mansoni	cercarial elastase (S01 family)	0.0026	0.0313	0.0728
Brugia malayi	TAR-binding protein	0.0061	0.1342	0.1342
Echinococcus granulosus	cathepsin L cysteine proteinase	0.0048	0.0975	0.2238
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.0863	0.2006
Onchocerca volvulus		0.004	0.073	0.6673
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0016	0.0044	0.1199
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0027	0.0354	0.0824
Brugia malayi	Inhibitor of Apoptosis domain containing protein	0.004	0.073	0.073
Leishmania major	cathepsin L-like protease	0.0048	0.0975	0.096
Leishmania major	cathepsin L-like protease	0.0048	0.0975	0.096

Activities

Activity type	Activity value	Assay description	Source	Reference
Ki (binding)		Inhibition of human thrombin using chromogenic Sar-Pro-Arg p-nitroanilide dihydrochloride as substrate pre-incubated for 10 mins by spectrophotometry	ChEMBL.	21807511
Ratio (binding)	= 0.71	Inhibition of human thrombin assessed as residual enzyme activity using chromogenic Sar-Pro-Arg p-nitroanilide dihydrochloride as substrate at 10 uM pre-incubated for 10 mins by spectrophotometry relative to untreated control	ChEMBL.	21807511
Ratio (binding)	= 0.99	Inhibition of human chymase assessed as residual enzyme activity using chromogenic N-succinyl-Ala-Ala-Pro-Phe p-nitroanilide as substrate at 10 uM pre-incubated for 10 mins by spectrophotometry relative to untreated control	ChEMBL.	21807511

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: CHEMBL1824557

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1044017