TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 373.426 | Formula: C18H19N3O4S
H donors: 2 H acceptors: 4 LogP: 2.91 Rotable bonds: 7
Rule of 5 violations (Lipinski): 1
SMILES: N#Cc1ccc(c(c1)S(=O)(=O)NC(=O)NC(C)C)Oc1cccc(c1)C
InChi: 1S/C18H19N3O4S/c1-12(2)20-18(22)21-26(23,24)17-10-14(11-19)7-8-16(17)25-15-6-4-5-13(3)9-15/h4-10,12H,1-3H3,(H2,20,21,22)
InChiKey: XWNRCAHBDJBJRN-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

Species	Target name	Source	Bibliographic reference
Homo sapiens	thromboxane A2 receptor	Starlite/ChEMBL	References

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
Schistosoma mansoni	cathepsin F (C01 family)	0.0036	0.0116	0.1286
Trypanosoma cruzi	cysteine peptidase (N-terminal), putative	0.0028	0.0063	0.0169
Trypanosoma cruzi	Peptide deformylase 2, putative	0.0603	0.3746	1
Brugia malayi	Matrixin family protein	0.0072	0.0344	0.2559
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	0.0021	0.0023	0.0169
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0054	0.0229	0.1355
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0204	0.1192	0.3141
Trypanosoma cruzi	Peptide deformylase 2, putative	0.0603	0.3746	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0054	0.0229	0.1355
Trypanosoma cruzi	cysteine peptidase, putative	0.0204	0.1192	0.3182
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.0054	0.0229	0.0207
Leishmania major	T-complex protein 1, beta subunit, putative	0.0027	0.0062	0.0105
Brugia malayi	Cathepsin L-like cysteine proteinase	0.0036	0.0116	0.0862
Plasmodium vivax	vivapain-1	0.0028	0.0063	0.0063
Brugia malayi	Cathepsin L-like precursor	0.0036	0.0116	0.0862
Brugia malayi	Matrixin family protein	0.0072	0.0344	0.2559
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0054	0.0229	0.1355
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0033	0.0096	0.1064
Leishmania major	cathepsin L-like protease	0.0054	0.0229	0.0555
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0204	0.1192	0.3141
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0054	0.0229	0.1355
Giardia lamblia	Histone acetyltransferase GCN5	0.0043	0.0161	1
Loa Loa (eye worm)	cysteine protease	0.0054	0.0229	0.1704
Brugia malayi	Cathepsin L-like precursor	0.0054	0.0229	0.1704
Echinococcus granulosus	histone lysine methyltransferase setb	0.0033	0.0096	0.0578
Trypanosoma cruzi	polypeptide deformylase-like protein, putative	0.0603	0.3746	1
Brugia malayi	Cathepsin L-like precursor	0.0054	0.0229	0.1704
Schistosoma mansoni	chaperonin containing t-complex protein 1 beta subunit tcpb	0.0027	0.0062	0.0685
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0052	0.0218	0.1617
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0033	0.0096	0.1064
Onchocerca volvulus	Cathepsin L homolog	0.0054	0.0229	0.0918
Trypanosoma cruzi	polypeptide deformylase-like protein, putative	0.0603	0.3746	1
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0116	0.0862
Schistosoma mansoni	hypothetical protein	0.0037	0.0126	0.1392
Trypanosoma cruzi	major cysteine proteinase, putative	0.016	0.0913	0.2437
Trypanosoma cruzi	cysteine peptidase, putative	0.0054	0.0229	0.0612
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0052	0.0218	0.241
Entamoeba histolytica	cysteine proteinase, putative	0.0028	0.0063	0.1958
Schistosoma mansoni	cathepsin F (C01 family)	0.0054	0.0229	0.254
Entamoeba histolytica	cysteine protease, putative	0.0028	0.0063	0.1958
Brugia malayi	Papain family cysteine protease containing protein	0.0028	0.0063	0.047
Onchocerca volvulus	Matrilysin homolog	0.0159	0.0902	0.5551
Entamoeba histolytica	cysteine protease, putative	0.0028	0.0063	0.1958
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0054	0.0229	0.1355
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0028	0.0063	0.07
Echinococcus granulosus	cathepsin L cysteine proteinase	0.0054	0.0229	0.1629
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0054	0.0229	0.1629
Trichomonas vaginalis	cat eye syndrome critical region protein 2, cscr2, putative	0.0047	0.0186	0.1068
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0055	0.0236	0.1755
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.0033	0.0096	0.0073
Toxoplasma gondii	cathepsin CPL	0.0054	0.0229	0.0207
Loa Loa (eye worm)	ctsf protein	0.0054	0.0229	0.1704
Entamoeba histolytica	cysteine protease, putative	0.0028	0.0063	0.1958
Echinococcus granulosus	cathepsin l1	0.0054	0.0229	0.1629
Echinococcus granulosus	chaperonin containing TCP1 subunit 2 beta	0.0027	0.0062	0.0308
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0054	0.0229	0.1355
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0116	0.0862
Plasmodium vivax	histone acetyltransferase GCN5, putative	0.0047	0.0186	0.0186
Onchocerca volvulus		0.0054	0.0229	0.0918
Brugia malayi	Matrixin family protein	0.0132	0.0734	0.5451
Entamoeba histolytica	cysteine protease, putative	0.0054	0.0229	1
Brugia malayi	Cathepsin L-like precursor	0.0036	0.0116	0.0862
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0204	0.1192	0.3141
Trypanosoma cruzi	cysteine proteinase, putative	0.0028	0.0063	0.0169
Mycobacterium tuberculosis	Probable peptidoglycan hydrolase	0.0087	0.0444	0.0422
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0036	0.0116	0.0612
Toxoplasma gondii	t-complex protein beta subunit	0.0027	0.0062	0.0039
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0055	0.0236	0.1755
Leishmania major	cathepsin L-like protease	0.0054	0.0229	0.0555
Echinococcus granulosus	cysteine protease	0.0028	0.0063	0.0319
Schistosoma mansoni	hypothetical protein	0.0061	0.0276	0.3057
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0054	0.0229	0.1355
Entamoeba histolytica	T-complex protein 1 beta subunit, putative	0.0027	0.0062	0.1891
Echinococcus multilocularis	cysteine protease	0.0054	0.0229	0.1629
Echinococcus granulosus	histone acetyltransferase KAT2B	0.0047	0.0186	0.1284
Trypanosoma cruzi	cysteine protease, putative	0.0028	0.0063	0.0169
Entamoeba histolytica	cysteine proteinase, putative	0.0028	0.0063	0.1958
Brugia malayi	Cathepsin L-like precursor	0.0054	0.0229	0.1704
Loa Loa (eye worm)	matrixin family protein	0.0159	0.0902	0.67
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.0054	0.0229	0.0207
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.0032	0.0088	0.0517
Brugia malayi	Cathepsin L-like precursor	0.0054	0.0229	0.1704
Entamoeba histolytica	cysteine protease, putative	0.0028	0.0063	0.1958
Leishmania major	cathepsin L-like protease	0.0054	0.0229	0.0555
Onchocerca volvulus	Cathepsin F homolog	0.0054	0.0229	0.0918
Brugia malayi	exodeoxyribonuclease III family protein	0.0021	0.0023	0.0169
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0052	0.0218	0.1536
Plasmodium falciparum	peptide deformylase	0.1581	1	1
Entamoeba histolytica	cysteine protease, putative	0.0028	0.0063	0.1958
Trypanosoma cruzi	cruzipain precursor, putative	0.0204	0.1192	0.3182
Echinococcus granulosus	cathepsin L	0.0028	0.0063	0.0319
Schistosoma mansoni	gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2	0.0159	0.0903	1
Brugia malayi	Hemopexin family protein	0.0061	0.0276	0.2051
Leishmania major	cathepsin L-like protease	0.0204	0.1192	0.3141
Loa Loa (eye worm)	matrix metalloproteinase	0.0072	0.0344	0.2559
Entamoeba histolytica	cysteine protease, putative	0.0028	0.0063	0.1958
Onchocerca volvulus	Cathepsin L homolog	0.0054	0.0229	0.0918
Onchocerca volvulus		0.0054	0.0229	0.0918
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0052	0.0218	0.1536
Onchocerca volvulus		0.0036	0.0116	0.0138
Entamoeba histolytica	cysteine protease, putative	0.0028	0.0063	0.1958
Plasmodium falciparum	cysteine proteinase falcipain 1	0.0028	0.0063	0.0041
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0096	0.0714
Loa Loa (eye worm)	matrixin family protein	0.0132	0.0734	0.5451
Entamoeba histolytica	cysteine protease, putative	0.0028	0.0063	0.1958
Toxoplasma gondii	histone lysine acetyltransferase GCN5-B	0.0047	0.0186	0.0163
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0047	0.0186	0.1068
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.0033	0.0096	0.1064
Trypanosoma cruzi	cysteine peptidase, putative	0.0204	0.1192	0.3182
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0054	0.0229	0.1355
Leishmania major	cathepsin L-like protease	0.0054	0.0229	0.0555
Trypanosoma cruzi	cysteine proteinase, putative	0.0028	0.0063	0.0169
Trypanosoma brucei	Polypeptide deformylase 1	0.0603	0.3746	1
Echinococcus granulosus	cathepsin L cysteine protease	0.0028	0.0063	0.0319
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0228	0.1346	1
Echinococcus granulosus	matrix metallopeptidase 7 M10 family	0.022	0.1291	1
Echinococcus granulosus	histone acetyltransferase KAT2B	0.0154	0.0874	0.6715
Brugia malayi	Cathepsin L-like precursor	0.0054	0.0229	0.1704
Onchocerca volvulus	Matrilysin homolog	0.0072	0.0344	0.1711
Entamoeba histolytica	cysteine proteinase, putative	0.0036	0.0116	0.4517
Echinococcus granulosus	cathepsin l cysteine peptidase	0.0054	0.0229	0.1629
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0054	0.0229	0.1355
Plasmodium vivax	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0021	0.0023	0.0023
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0033	0.0096	0.1064
Plasmodium falciparum	cysteine proteinase falcipain 3	0.0054	0.0229	0.0207
Loa Loa (eye worm)	hypothetical protein	0.0072	0.0344	0.2559
Brugia malayi	Papain family cysteine protease containing protein	0.0054	0.0229	0.1704
Entamoeba histolytica	cysteine protease, putative	0.0028	0.0063	0.1958
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0028	0.0063	0.07
Brugia malayi	latrophilin 2 splice variant baaae	0.0037	0.0126	0.0934
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0052	0.0218	0.1536
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0054	0.0229	0.1629
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0054	0.0229	0.1704
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0054	0.0229	0.1355
Plasmodium falciparum	T-complex protein 1 subunit beta	0.0027	0.0062	0.0039
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0054	0.0229	0.1355
Plasmodium vivax	vivapain-3	0.0028	0.0063	0.0063
Onchocerca volvulus		0.0054	0.0229	0.0918
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0054	0.0229	0.1355
Onchocerca volvulus		0.0054	0.0229	0.0918
Echinococcus multilocularis	cathepsin L cysteine protease	0.0054	0.0229	0.1629
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0028	0.0063	0.0265
Trypanosoma cruzi	T-complex protein 1, beta subunit, putative	0.0027	0.0062	0.0165
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease	0.0021	0.0023	0.0061
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0036	0.0116	0.0612
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0052	0.0218	0.241
Plasmodium vivax	vivapain-2	0.0054	0.0229	0.0229
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0054	0.0229	0.1355
Loa Loa (eye worm)	hypothetical protein	0.0087	0.0444	0.33
Entamoeba histolytica	cysteine protease, putative	0.0028	0.0063	0.1958
Leishmania major	cathepsin L-like protease	0.0204	0.1192	0.3141
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0054	0.0229	0.1355
Echinococcus multilocularis	cathepsin L	0.0028	0.0063	0.0319
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0054	0.0229	0.1355
Brugia malayi	Cathepsin L-like precursor	0.0054	0.0229	0.1704
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0028	0.0063	0.0109
Entamoeba histolytica	cysteine proteinase, putative	0.0054	0.0229	1
Schistosoma mansoni	cathepsin F (C01 family)	0.0054	0.0229	0.254
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0204	0.1192	0.3141
Schistosoma mansoni	chaperonin containing t-complex protein 1 beta subunit tcpb	0.0027	0.0062	0.0685
Leishmania major	cathepsin L-like protease	0.0054	0.0229	0.0555
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0054	0.0229	0.1355
Brugia malayi	Matrix metalloprotease, N-terminal domain containing protein	0.0087	0.0444	0.33
Loa Loa (eye worm)	hypothetical protein	0.0055	0.0236	0.1755
Trypanosoma brucei	T-complex protein 1, beta subunit, putative	0.0027	0.0062	0.0105
Trichomonas vaginalis	set domain proteins, putative	0.026	0.1548	1
Brugia malayi	Papain family cysteine protease containing protein	0.0028	0.0063	0.047
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0028	0.0063	0.07
Treponema pallidum	polypeptide deformylase (def)	0.1581	1	1
Entamoeba histolytica	cysteine protease, putative	0.0028	0.0063	0.1958
Mycobacterium ulcerans	hydrolase	0.0087	0.0444	0.0422
Brugia malayi	cathepsin L-like precursor	0.0036	0.0116	0.0862
Entamoeba histolytica	cysteine proteinase, putative	0.0028	0.0063	0.1958
Entamoeba histolytica	cysteine proteinase, putative	0.0054	0.0229	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0054	0.0229	0.1355
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0054	0.0229	0.1355
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0052	0.0218	0.1536
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.0186	0.1079	0.288
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0055	0.0236	0.1755
Onchocerca volvulus		0.0054	0.0229	0.0918
Brugia malayi	T-complex protein 1, beta subunit	0.0027	0.0062	0.0459
Loa Loa (eye worm)	fibroinase	0.0054	0.0229	0.1704
Plasmodium vivax	SET domain protein, putative	0.0033	0.0096	0.0096
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0054	0.0229	0.1355
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0204	0.1192	0.3141
Leishmania major	cysteine peptidase A (CPA)	0.0054	0.0229	0.0555
Trypanosoma brucei	Peptide deformylase 2	0.0603	0.3746	1
Brugia malayi	Pre-SET motif family protein	0.0033	0.0096	0.0714
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.0054	0.0229	0.1704
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0054	0.0229	0.1355
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0204	0.1192	0.3141
Schistosoma mansoni	ap endonuclease	0.0021	0.0023	0.0252
Entamoeba histolytica	cysteine protease, putative	0.0028	0.0063	0.1958
Trichomonas vaginalis	chaperonin, putative	0.0027	0.0062	0.0256
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0054	0.0229	0.1355
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.0033	0.0096	0.0578
Entamoeba histolytica	cysteine proteinase 1, putative	0.0028	0.0063	0.1958
Echinococcus granulosus	cathepsin l1	0.0036	0.0116	0.0736
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0204	0.1192	0.3141
Schistosoma mansoni	matrix metallopeptidase-7 (M10 family)	0.0072	0.0344	0.3814
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0204	0.1192	0.3141
Onchocerca volvulus		0.0061	0.0276	0.124
Echinococcus multilocularis	matrix metallopeptidase 7 (M10 family)	0.022	0.1291	1
Onchocerca volvulus	Matrix metalloproteinase homolog	0.0159	0.0902	0.5551
Entamoeba histolytica	cysteine proteinase 2	0.0028	0.0063	0.1958
Loa Loa (eye worm)	hypothetical protein	0.0054	0.0229	0.1704
Onchocerca volvulus		0.0072	0.0344	0.1711
Brugia malayi	acetyltransferase, GNAT family protein	0.0159	0.0903	0.6709
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0126	0.0934
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0052	0.0218	0.241
Entamoeba histolytica	cysteine protease, putative	0.0028	0.0063	0.1958
Brugia malayi	Pre-SET motif family protein	0.0228	0.1346	1
Echinococcus multilocularis	cathepsin L cysteine protease	0.0054	0.0229	0.1629
Brugia malayi	Matrixin family protein	0.0072	0.0344	0.2559
Loa Loa (eye worm)	hypothetical protein	0.0072	0.0344	0.2559
Brugia malayi	Matrixin family protein	0.0072	0.0344	0.2559
Brugia malayi	T-complex protein 1, beta subunit	0.0027	0.0062	0.0459
Mycobacterium ulcerans	peptide deformylase	0.1581	1	1
Trichomonas vaginalis	chaperonin-60kD, ch60, putative	0.0027	0.0062	0.0256
Plasmodium vivax	vivapain-2	0.0054	0.0229	0.0229
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0116	0.0862
Echinococcus multilocularis	cysteine protease	0.0054	0.0229	0.1629
Onchocerca volvulus		0.0054	0.0229	0.0918
Entamoeba histolytica	cysteine proteinase, putative	0.0028	0.0063	0.1958
Plasmodium vivax	T-complex protein 1 subunit beta, putative	0.0027	0.0062	0.0062
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0033	0.0096	0.0578
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0028	0.0063	0.0109
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease, putative	0.0021	0.0023	0.0061
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0028	0.0063	0.0265
Leishmania major	cathepsin L-like protease	0.0204	0.1192	0.3141
Loa Loa (eye worm)	T-complex protein 1	0.0027	0.0062	0.0459
Plasmodium falciparum	histone acetyltransferase GCN5	0.0043	0.0161	0.0138
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0052	0.0218	0.1617
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0054	0.0229	0.1355
Schistosoma mansoni	ap endonuclease	0.0021	0.0023	0.0252
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0054	0.0229	0.1355
Toxoplasma gondii	histone lysine acetyltransferase GCN5-A	0.0047	0.0186	0.0163
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0204	0.1192	0.3141
Mycobacterium tuberculosis	Probable polypeptide deformylase Def (PDF) (formylmethionine deformylase)	0.1581	1	1
Trypanosoma cruzi	cysteine peptidase, putative	0.0204	0.1192	0.3182
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0204	0.1192	0.3141
Loa Loa (eye worm)	acetyltransferase	0.0159	0.0903	0.6709
Wolbachia endosymbiont of Brugia malayi	peptide deformylase	0.1581	1	1
Echinococcus multilocularis	gcn5proteinral control of amino acid synthesis	0.0159	0.0903	0.694
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0204	0.1192	0.3141
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0054	0.0229	0.1355
Plasmodium vivax	unspecified product	0.0028	0.0063	0.0063
Onchocerca volvulus		0.0054	0.0229	0.0918
Schistosoma mansoni	chaperonin containing t-complex protein 1 beta subunit tcpb	0.0027	0.0062	0.0685
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0054	0.0229	0.1355
Leishmania major	polypeptide deformylase-like protein, putative	0.0603	0.3746	1
Echinococcus multilocularis	chaperonin containing TCP1, subunit 2 (beta)	0.0027	0.0062	0.0308
Entamoeba histolytica	acetyltransferase, GNAT family	0.0043	0.0161	0.6676
Onchocerca volvulus		0.026	0.1548	1
Mycobacterium leprae	PROBABLE POLYPEPTIDE DEFORMYLASE DEF (PDF) (FORMYLMETHIONINE DEFORMYLASE)	0.1581	1	1
Giardia lamblia	TCP-1 chaperonin subunit beta	0.0027	0.0062	0.2832
Toxoplasma gondii	hypothetical protein	0.1581	1	1
Loa Loa (eye worm)	hypothetical protein	0.0072	0.0344	0.2559
Plasmodium vivax	peptide deformylase, putative	0.1581	1	1
Trypanosoma cruzi	cysteine peptidase, putative	0.0028	0.0063	0.0169

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (functional)	= 1.69 uM	Antagonist activity at human thromboxane A2 receptor beta over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular calcium mobilization mobilization by fluorescence assay	ChEMBL.	23688698
IC50 (functional)	= 2.38 uM	Antagonist activity at human thromboxane A2 receptor alpha over-expressed in HEK293 cells assessed as inhibition of U-46619-induced intracellular calcium mobilization by fluorescence assay	ChEMBL.	23688698

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: CHEMBL2402422

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1776396