TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 585.503 | Formula: C22H18Cl2N4O5S3
H donors: 3 H acceptors: 5 LogP: 3.94 Rotable bonds: 8
Rule of 5 violations (Lipinski): 2
SMILES: Clc1ccc(cc1)NC(=O)c1cc2c(cc1Cl)SC(=NS2(=O)=O)NCCc1ccc(cc1)S(=O)(=O)N
InChi: 1S/C22H18Cl2N4O5S3/c23-14-3-5-15(6-4-14)27-21(29)17-11-20-19(12-18(17)24)34-22(28-36(20,32)33)26-10-9-13-1-7-16(8-2-13)35(25,30)31/h1-8,11-12H,9-10H2,(H,26,28)(H,27,29)(H2,25,30,31)
InChiKey: LRSSSNQOPCXKKJ-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
Trypanosoma cruzi	glucose transporter, putative	0.0014	0.0201	0.2874
Trichomonas vaginalis	conserved hypothetical protein	0.0032	0.0606	0.269
Schistosoma mansoni	lysyl-tRNA synthetase	0.0023	0.0399	0.1769
Leishmania major	lysyl-tRNA synthetase, putative	0.0023	0.0399	0.5689
Toxoplasma gondii	sugar transporter ST3	0.0014	0.0201	0.0305
Mycobacterium ulcerans	exodeoxyribonuclease III protein XthA	0.0018	0.0295	0.7409
Brugia malayi	hypothetical protein	0.0012	0.0142	0.0631
Plasmodium falciparum	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0018	0.0295	0.0295
Onchocerca volvulus	Putative transporter	0.0014	0.0201	1
Trypanosoma cruzi	prolyl-tRNA synthetase, putative	0.0036	0.0701	1
Plasmodium vivax	calcium-dependent protein kinase, putative	0.0031	0.0597	0.0597
Trichomonas vaginalis	conserved hypothetical protein	0.0014	0.0201	0.0894
Trypanosoma cruzi	prolyl-tRNA synthetase, putative	0.0036	0.0701	1
Trichomonas vaginalis	sugar transporter, putative	0.0014	0.0201	0.0894
Echinococcus multilocularis	solute carrier family 2, facilitated glucose	0.0102	0.2253	1
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0044	0.0911	0.4042
Trichomonas vaginalis	sugar transporter, putative	0.0014	0.0201	0.0894
Onchocerca volvulus		0.0014	0.0201	1
Trichomonas vaginalis	sugar transporter, putative	0.0014	0.0201	0.0894
Giardia lamblia	Sugar-proton symporter	0.0014	0.0201	0.346
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease	0.0018	0.0295	0.4215
Echinococcus multilocularis	solute carrier family 22	0.0014	0.0201	0.0894
Leishmania major	prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative	0.0036	0.0701	1
Trichomonas vaginalis	sugar transporter, putative	0.0014	0.0201	0.0894
Trichomonas vaginalis	sugar transporter, putative	0.0014	0.0201	0.0894
Plasmodium vivax	proline--tRNA ligase, putative	0.0036	0.0701	0.0701
Trichomonas vaginalis	ap endonuclease, putative	0.0018	0.0295	0.1311
Toxoplasma gondii	sugar transporter ST2	0.0014	0.0201	0.0305
Echinococcus granulosus	calcium dependent protein kinase	0.0029	0.0552	0.2448
Trichomonas vaginalis	glucose transporter, putative	0.0014	0.0201	0.0894
Trichomonas vaginalis	sugar transporter, putative	0.0014	0.0201	0.0894
Brugia malayi	bifunctional aminoacyl-tRNA synthetase	0.003	0.0582	0.2583
Brugia malayi	Carboxylesterase family protein	0.0012	0.0142	0.0631
Schistosoma mansoni	sugar transporter	0.0014	0.0201	0.0894
Brugia malayi	Bifunctional aminoacyl-tRNA synthetase	0.003	0.0582	0.2583
Mycobacterium tuberculosis	Carboxylesterase LipT	0.0012	0.0142	0.4466
Echinococcus granulosus	acetylcholinesterase	0.007	0.1502	0.6666
Echinococcus multilocularis	solute carrier family 22	0.0014	0.0201	0.0894
Schistosoma mansoni	glucose transporter	0.0014	0.0201	0.0894
Plasmodium vivax	sugar transporter, putative	0.0014	0.0201	0.0201
Onchocerca volvulus		0.0014	0.0201	1
Loa Loa (eye worm)	major facilitator superfamily transporter	0.0014	0.0201	0.0894
Onchocerca volvulus		0.0014	0.0201	1
Echinococcus multilocularis	glutamyl tRNA synthetase cytoplasmic	0.003	0.0582	0.2583
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0044	0.0911	0.4042
Trichomonas vaginalis	sugar transporter, putative	0.0014	0.0201	0.0894
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0142	0.0631
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0201	0.0894
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0606	0.8651
Trichomonas vaginalis	glucose transporter, putative	0.0032	0.0606	0.269
Toxoplasma gondii	calcium-dependent protein kinase CDPK3	0.0031	0.0597	0.0903
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0201	0.0894
Toxoplasma gondii	lysine-tRNA ligase	0.0023	0.0399	0.0603
Schistosoma mansoni	lysyl-tRNA synthetase	0.0023	0.0399	0.1769
Mycobacterium ulcerans	fusion protein of transposase for IS2606 and sialic acid-transport integral membrane protein NanT	0.0014	0.0201	0.5052
Loa Loa (eye worm)	sugar transporter	0.0014	0.0201	0.0894
Trichomonas vaginalis	sugar transporter, putative	0.0014	0.0201	0.0894
Trypanosoma brucei	calcium/calmodulin-dependent protein kinase, putative	0.0031	0.0597	0.8517
Trichomonas vaginalis	sugar transporter, putative	0.0014	0.0201	0.0894
Trichomonas vaginalis	sugar transporter, putative	0.0032	0.0606	0.269
Plasmodium vivax	calcium-dependent protein kinase 4, putative	0.0031	0.0597	0.0597
Schistosoma mansoni	glucose transport protein	0.0102	0.2253	1
Toxoplasma gondii	exonuclease III APE	0.0018	0.0295	0.0447
Leishmania major	myo-inositol/proton symporter (MIT)	0.0014	0.0201	0.2874
Wolbachia endosymbiont of Brugia malayi	exonuclease III	0.0018	0.0295	1
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0044	0.0911	0.4042
Brugia malayi	Major Facilitator Superfamily protein	0.0014	0.0201	0.0894
Mycobacterium leprae	Possible lysyl-tRNA synthetase 2 LysX	0.0023	0.0399	0.6849
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0142	0.0631
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0012	0.0142	0.0631
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0606	0.8651
Trichomonas vaginalis	sugar transporter, putative	0.0014	0.0201	0.0894
Echinococcus granulosus	solute carrier family 22	0.0014	0.0201	0.0894
Leishmania major	protein kinase, putative	0.0031	0.0597	0.8517
Brugia malayi	hypothetical protein	0.0014	0.0201	0.0894
Onchocerca volvulus		0.0014	0.0201	1
Mycobacterium leprae	Probable prolyl tRNA synthetase ProS	0.003	0.0582	1
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0399	0.1769
Brugia malayi	Carboxylesterase family protein	0.0012	0.0142	0.0631
Plasmodium falciparum	major facilitator superfamily domain-containing protein, putative	0.0014	0.0201	0.0201
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0031	0.0597	0.2648
Trichomonas vaginalis	sugar transporter, putative	0.0014	0.0201	0.0894
Trichomonas vaginalis	sugar transporter, putative	0.0014	0.0201	0.0894
Mycobacterium ulcerans	lysyl-tRNA synthetase	0.0023	0.0399	1
Echinococcus multilocularis	para nitrobenzyl esterase	0.0012	0.0142	0.0631
Plasmodium vivax	calcium-dependent protein kinase 1, putative	0.0031	0.0597	0.0597
Echinococcus granulosus	lysyl tRNA synthetase	0.0023	0.0399	0.1769
Plasmodium falciparum	calcium-dependent protein kinase 3	0.0031	0.0597	0.0597
Trichomonas vaginalis	sugar transporter, putative	0.0014	0.0201	0.0894
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0201	0.0894
Brugia malayi	Cam kinase protein 1	0.0031	0.0597	0.2648
Echinococcus multilocularis	Sugar transporter ERD6 protein	0.0014	0.0201	0.0894
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0201	0.0894
Trichomonas vaginalis	sugar transporter, putative	0.0032	0.0606	0.269
Echinococcus multilocularis	calcium dependent protein kinase	0.0029	0.0552	0.2448
Giardia lamblia	Lysyl-tRNA synthetase	0.0023	0.0399	0.6849
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0102	0.2253	1
Brugia malayi	exodeoxyribonuclease III family protein	0.0018	0.0295	0.1311
Trichomonas vaginalis	sugar transporter, putative	0.0014	0.0201	0.0894
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0597	0.2648
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0606	0.8651
Echinococcus multilocularis	BC026374 protein (S09 family)	0.0012	0.0142	0.0631
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0102	0.2253	1
Trypanosoma cruzi	hexose transporter	0.0032	0.0606	0.8651
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0606	0.8651
Loa Loa (eye worm)	hypothetical protein	0.003	0.0582	0.2583
Mycobacterium tuberculosis	Probable dicarboxylic acid transport integral membrane protein KgtP (dicarboxylate transporter)	0.0014	0.0201	0.6328
Trypanosoma cruzi	hexose transporter, putative	0.0014	0.0201	0.2874
Mycobacterium leprae	Probable lysyl-tRNA synthase LysS (lysine--tRNA ligase 1) (LysRS 1) (lysine translase)	0.0019	0.0318	0.5469
Trichomonas vaginalis	lysyl-tRNA synthetase, putative	0.002	0.0333	0.1477
Onchocerca volvulus		0.0014	0.0201	1
Leishmania major	glucose transporter, lmgt1	0.0032	0.0606	0.8651
Trichomonas vaginalis	sugar transporter, putative	0.0014	0.0201	0.0894
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0201	0.0894
Echinococcus granulosus	carboxylesterase 5A	0.007	0.1502	0.6666
Trichomonas vaginalis	conserved hypothetical protein	0.0014	0.0201	0.0894
Schistosoma mansoni	gliotactin	0.0012	0.0142	0.0631
Loa Loa (eye worm)	sugar transporter	0.0102	0.2253	1
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0102	0.2253	1
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0044	0.0911	0.4042
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0606	0.8651
Echinococcus multilocularis	neuroligin	0.0012	0.0142	0.0631
Mycobacterium ulcerans	carboxylesterase, LipT	0.0012	0.0142	0.3566
Schistosoma mansoni	sugar transporter	0.0014	0.0201	0.0894
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0044	0.0911	0.4042
Trichomonas vaginalis	spcc417.12 protein, putative	0.0012	0.0142	0.0631
Trypanosoma brucei	bifunctional aminoacyl-tRNA synthetase, putative	0.0036	0.0701	1
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0044	0.0911	0.4042
Plasmodium falciparum	protein kinase 7	0.0287	0.6612	0.6612
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0102	0.2253	1
Brugia malayi	Carboxylesterase family protein	0.0012	0.0142	0.0631
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0201	0.0894
Brugia malayi	major facilitator superfamily protein	0.0014	0.0201	0.0894
Toxoplasma gondii	facilitative glucose transporter GT1	0.0102	0.2253	0.3408
Brugia malayi	Calcium/calmodulin-dependent protein kinase type II alpha chain	0.0031	0.0597	0.2648
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0606	0.8651
Trichomonas vaginalis	sugar transporter, putative	0.0014	0.0201	0.0894
Toxoplasma gondii	sugar transporter ST1	0.0014	0.0201	0.0305
Mycobacterium ulcerans	sugar-transport integral membrane protein SugI	0.0014	0.0201	0.5052
Echinococcus multilocularis	acetylcholinesterase	0.007	0.1502	0.6666
Chlamydia trachomatis	lysine--tRNA ligase	0.0023	0.0399	1
Loa Loa (eye worm)	major facilitator superfamily transporter	0.0014	0.0201	0.0894
Echinococcus granulosus	neuroligin	0.0012	0.0142	0.0631
Echinococcus granulosus	Sugar transporter ERD6 protein	0.0014	0.0201	0.0894
Brugia malayi	Major Facilitator Superfamily protein	0.0014	0.0201	0.0894
Trypanosoma brucei	myo-inositol/proton symporter (MIT)	0.0014	0.0201	0.2874
Echinococcus multilocularis	lysyl tRNA synthetase	0.0023	0.0399	0.1769
Echinococcus multilocularis	carboxylesterase 5A	0.007	0.1502	0.6666
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0012	0.0142	0.4466
Onchocerca volvulus		0.0014	0.0201	1
Trichomonas vaginalis	sugar transport protein, putative	0.0014	0.0201	0.0894
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0012	0.0142	0.4466
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0031	0.0597	0.2648
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0031	0.0597	0.2648
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0102	0.2253	1
Loa Loa (eye worm)	carboxylesterase	0.0012	0.0142	0.0631
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0606	0.8651
Loa Loa (eye worm)	calcium/calmodulin-dependent protein kinase ID	0.0031	0.0597	0.2648
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0031	0.0597	0.2648
Plasmodium falciparum	calcium-dependent protein kinase 1	0.0031	0.0597	0.0597
Schistosoma mansoni	neuroligin 3 (S09 family)	0.0012	0.0142	0.0631
Brugia malayi	Carboxylesterase family protein	0.007	0.1502	0.6666
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0606	0.8651
Trichomonas vaginalis	sugar transporter, putative	0.0032	0.0606	0.269
Loa Loa (eye worm)	CAMK/CAMK2 protein kinase	0.0031	0.0597	0.2648
Toxoplasma gondii	calcium-dependent protein kinase CDPK2B	0.0031	0.0597	0.0903
Trichomonas vaginalis	sugar transporter, putative	0.0014	0.0201	0.0894
Trichomonas vaginalis	sugar transporter, putative	0.0014	0.0201	0.0894
Echinococcus multilocularis	DNA (apurinic or apyrimidinic site) lyase	0.0018	0.0295	0.1311
Trichomonas vaginalis	sugar transporter, putative	0.0014	0.0201	0.0894
Plasmodium falciparum	calcium-dependent protein kinase 5	0.0031	0.0597	0.0597
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0044	0.0911	0.4042
Trichomonas vaginalis	conserved hypothetical protein	0.0102	0.2253	1
Plasmodium falciparum	calcium-dependent protein kinase 2	0.0031	0.0597	0.0597
Toxoplasma gondii	prolyl-tRNA synthetase (ProRS)	0.0036	0.0701	0.106
Entamoeba histolytica	exodeoxyribonuclease III, putative	0.0018	0.0295	0.4949
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0012	0.0142	0.0631
Brugia malayi	Sugar transporter family protein	0.0102	0.2253	1
Trichomonas vaginalis	sugar transporter, putative	0.0014	0.0201	0.0894
Trichomonas vaginalis	sugar transporter, putative	0.0014	0.0201	0.0894
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0142	0.0631
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0102	0.2253	1
Schistosoma mansoni	BC026374 protein (S09 family)	0.0012	0.0142	0.0631
Trichomonas vaginalis	conserved hypothetical protein	0.0014	0.0201	0.0894
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0012	0.0142	0.0631
Mycobacterium ulcerans	sugar transporter	0.0014	0.0201	0.5052
Echinococcus granulosus	solute carrier family 22	0.0014	0.0201	0.0894
Entamoeba histolytica	prolyl-tRNA synthetase, putative	0.003	0.0582	0.9752
Toxoplasma gondii	calcium-dependent protein kinase CDPK2A	0.0031	0.0597	0.0903
Echinococcus granulosus	family S9 non peptidase ue S09 family	0.0012	0.0142	0.0631
Plasmodium falciparum	hexose transporter	0.0102	0.2253	0.2253
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0201	0.0894
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0142	0.0631
Mycobacterium tuberculosis	Probable conserved integral membrane transport protein	0.0014	0.0201	0.6328
Brugia malayi	Major Facilitator Superfamily protein	0.0014	0.0201	0.0894
Loa Loa (eye worm)	bifunctional aminoacyl-tRNA synthetase	0.0013	0.016	0.0709
Trypanosoma cruzi	hexose transporter, putative	0.0032	0.0606	0.8651
Mycobacterium tuberculosis	Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI)	0.0018	0.0295	0.9279
Trichomonas vaginalis	glucose transporter, putative	0.0032	0.0606	0.269
Trichomonas vaginalis	conserved hypothetical protein	0.0014	0.0201	0.0894
Leishmania major	glucose transporter/membrane transporter D2, putative	0.0032	0.0606	0.8651
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type 1	0.0031	0.0597	0.2648
Trichomonas vaginalis	sugar transporter, putative	0.0014	0.0201	0.0894
Plasmodium falciparum	mitogen-activated protein kinase 2	0.0164	0.3724	0.3724
Mycobacterium ulcerans	integral membrane transport protein	0.0014	0.0201	0.5052
Trypanosoma cruzi	lysyl-tRNA synthetase, putative	0.0023	0.0399	0.5689
Echinococcus granulosus	para nitrobenzyl esterase	0.0012	0.0142	0.0631
Onchocerca volvulus		0.0014	0.0201	1
Trypanosoma cruzi	sugar transporter, putative	0.0014	0.0201	0.2874
Brugia malayi	major facilitator superfamily protein	0.0014	0.0201	0.0894
Plasmodium vivax	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0018	0.0295	0.0295
Trichomonas vaginalis	ap endonuclease, putative	0.0018	0.0295	0.1311
Loa Loa (eye worm)	carboxylesterase	0.0012	0.0142	0.0631
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0031	0.0597	0.2648
Schistosoma mansoni	glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs)	0.003	0.0582	0.2583
Schistosoma mansoni	glucose transport protein	0.0102	0.2253	1
Treponema pallidum	prolyl-tRNA synthetase	0.0011	0.0119	0.4019
Trichomonas vaginalis	sugar transporter, putative	0.0014	0.0201	0.0894
Onchocerca volvulus		0.0014	0.0201	1
Echinococcus granulosus	solute carrier family 22	0.0014	0.0201	0.0894
Echinococcus granulosus	solute carrier family 22	0.0014	0.0201	0.0894
Trichomonas vaginalis	sugar transporter, putative	0.0014	0.0201	0.0894
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0032	0.0606	0.8651
Echinococcus granulosus	General substrate transporter	0.0087	0.1918	0.851
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0201	0.0894
Schistosoma mansoni	glucose transport protein	0.0102	0.2253	1
Schistosoma mansoni	sugar transporter	0.0014	0.0201	0.0894
Echinococcus multilocularis	solute carrier family 22	0.0014	0.0201	0.0894
Trichomonas vaginalis	sugar transporter, putative	0.0014	0.0201	0.0894
Plasmodium vivax	CDK-related protein kinase 6, putative	0.0431	1	1
Trypanosoma brucei	apurinic/apyrimidinic endonuclease, putative	0.0018	0.0295	0.4215
Onchocerca volvulus		0.0014	0.0201	1
Onchocerca volvulus		0.0014	0.0201	1
Loa Loa (eye worm)	hypothetical protein	0.007	0.1502	0.6666
Trypanosoma brucei	glucose transporter 2A	0.0032	0.0606	0.8651
Trichomonas vaginalis	prolyl-tRNA synthetase, putative	0.003	0.0582	0.2583
Echinococcus granulosus	DNA apurinic or apyrimidinic site lyase	0.0018	0.0295	0.1311
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0201	0.0894
Echinococcus multilocularis	synaptic vesicle 2 protein	0.0014	0.0201	0.0894
Trichomonas vaginalis	sugar transporter, putative	0.0014	0.0201	0.0894
Trichomonas vaginalis	CAMK family protein kinase	0.0031	0.0597	0.2648
Schistosoma mansoni	protein kinase	0.0031	0.0597	0.2648
Chlamydia trachomatis	proline--tRNA ligase	0.0011	0.0119	0.2978
Leishmania major	hypothetical protein, conserved	0.0014	0.0201	0.2874
Entamoeba histolytica	protein kinase, putative	0.0031	0.0597	1
Brugia malayi	Sugar transporter family protein	0.0014	0.0201	0.0894
Schistosoma mansoni	acetylcholinesterase	0.0012	0.0142	0.0631
Mycobacterium ulcerans	lysyl-tRNA synthetase	0.0023	0.0399	1
Leishmania major	prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative	0.0036	0.0701	1
Trichomonas vaginalis	sugar transporter, putative	0.0014	0.0201	0.0894
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0044	0.0911	0.4042
Treponema pallidum	exodeoxyribonuclease (exoA)	0.0018	0.0295	1
Trichomonas vaginalis	sugar transporter, putative	0.0014	0.0201	0.0894
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0201	0.0894
Trypanosoma brucei	lysyl-tRNA synthetase, putative	0.0023	0.0399	0.5689
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0201	0.0894
Trichomonas vaginalis	conserved hypothetical protein	0.0032	0.0606	0.269
Trichomonas vaginalis	lysyl-tRNA synthetase, putative	0.0023	0.0399	0.1769
Loa Loa (eye worm)	carboxylesterase	0.007	0.1502	0.6666
Trichomonas vaginalis	sugar transporter, putative	0.0014	0.0201	0.0894
Toxoplasma gondii	transporter, major facilitator family protein	0.0014	0.0201	0.0305
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	0.0018	0.0295	0.1311
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0032	0.0606	0.8651
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0201	0.0894
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0201	0.0894
Schistosoma mansoni	protein kinase	0.0031	0.0597	0.2648
Trichomonas vaginalis	sugar transporter, putative	0.0014	0.0201	0.0894
Loa Loa (eye worm)	hypothetical protein	0.007	0.1502	0.6666
Onchocerca volvulus		0.0014	0.0201	1
Plasmodium vivax	calcium-dependent protein kinase 3, putative	0.0031	0.0597	0.0597
Schistosoma mansoni	serine/threonine protein kinase	0.0031	0.0597	0.2648
Plasmodium falciparum	calcium-dependent protein kinase 4	0.0031	0.0597	0.0597
Trichomonas vaginalis	sugar transporter, putative	0.0014	0.0201	0.0894
Trypanosoma cruzi	hexose transporter, putative	0.0017	0.027	0.386
Schistosoma mansoni	protein kinase	0.0031	0.0597	0.2648
Onchocerca volvulus		0.0014	0.0201	1
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0142	0.0631
Trypanosoma cruzi	hexose transporter, putative	0.0032	0.0606	0.8651
Trichomonas vaginalis	sugar transporter, putative	0.0014	0.0201	0.0894
Schistosoma mansoni	ap endonuclease	0.0018	0.0295	0.1311
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0142	0.0631
Brugia malayi	Carboxylesterase family protein	0.0012	0.0142	0.0631
Leishmania major	glucose transporter, lmgt2	0.0032	0.0606	0.8651
Mycobacterium ulcerans	prolyl-tRNA synthetase	0.0011	0.0119	0.2978
Toxoplasma gondii	protein kinase, putative	0.0287	0.6612	1
Wolbachia endosymbiont of Brugia malayi	major facilitator superfamily permease	0.0014	0.0201	0.6819
Trichomonas vaginalis	sugar transporter, putative	0.0014	0.0201	0.0894
Plasmodium falciparum	lysine--tRNA ligase	0.0023	0.0399	0.0399
Echinococcus multilocularis	acetylcholinesterase	0.007	0.1502	0.6666
Trypanosoma brucei	sugar transporter, putative	0.0014	0.0201	0.2874
Schistosoma mansoni	hypothetical protein	0.0102	0.2253	1
Echinococcus multilocularis	General substrate transporter	0.0087	0.1918	0.851
Giardia lamblia	Endonuclease/Exonuclease/phosphatase	0.0018	0.0295	0.5075
Echinococcus granulosus	BC026374 protein S09 family	0.0012	0.0142	0.0631
Mycobacterium tuberculosis	Lysyl-tRNA synthetase 2 LysX	0.0019	0.0318	1
Schistosoma mansoni	sugar transporter	0.0014	0.0201	0.0894
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0201	0.0894
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0031	0.0597	0.2648
Plasmodium vivax	mitogen-activated protein kinase 2, putative	0.0164	0.3724	0.3724
Loa Loa (eye worm)	acetylcholinesterase 1	0.007	0.1502	0.6666
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0032	0.0606	0.8651
Trichomonas vaginalis	sugar transporter, putative	0.0014	0.0201	0.0894
Onchocerca volvulus		0.0014	0.0201	1
Brugia malayi	hypothetical protein	0.0014	0.0201	0.0894
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0102	0.2253	1
Loa Loa (eye worm)	hypothetical protein	0.0014	0.0201	0.0894
Plasmodium vivax	lysine--tRNA ligase, putative	0.0023	0.0399	0.0399
Schistosoma mansoni	glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs)	0.003	0.0582	0.2583
Onchocerca volvulus		0.0014	0.0201	1
Brugia malayi	hypothetical protein	0.0014	0.0201	0.0894
Mycobacterium tuberculosis	Lysyl-tRNA synthetase 1 LysS (lysine--tRNA ligase 1) (LysRS 1) (lysine translase)	0.0019	0.0318	1
Echinococcus granulosus	glutamyl tRNA synthetase cytoplasmic	0.003	0.0582	0.2583
Brugia malayi	Sugar transporter family protein	0.0014	0.0201	0.0894
Brugia malayi	Carboxylesterase family protein	0.007	0.1502	0.6666
Echinococcus granulosus	synaptic vesicle 2 protein	0.0014	0.0201	0.0894
Entamoeba histolytica	protein kinase, putative	0.0031	0.0597	1
Leishmania major	apurinic/apyrimidinic endonuclease-redox protein	0.0018	0.0295	0.4215
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease, putative	0.0018	0.0295	0.4215
Onchocerca volvulus		0.0014	0.0201	1
Echinococcus granulosus	acetylcholinesterase	0.007	0.1502	0.6666
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0448	0.1987
Trichomonas vaginalis	conserved hypothetical protein	0.0014	0.0201	0.0894
Trypanosoma brucei	glucose transporter 1E	0.0032	0.0606	0.8651
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.007	0.1502	0.6666
Trichomonas vaginalis	carboxylesterase domain containing protein, putative	0.0012	0.0142	0.0631
Loa Loa (eye worm)	hypothetical protein	0.003	0.0582	0.2583
Giardia lamblia	Prolyl-tRNA synthetase	0.003	0.0582	1
Leishmania major	glucose transporter, lmgt3	0.0032	0.0606	0.8651
Echinococcus multilocularis	solute carrier family 22	0.0014	0.0201	0.0894
Echinococcus multilocularis	family S9 non peptidase ue (S09 family)	0.0012	0.0142	0.0631
Giardia lamblia	Hexose transporter	0.0014	0.0201	0.346
Trichomonas vaginalis	myo-inositol transporter, putative	0.0014	0.0201	0.0894
Brugia malayi	lysyl-tRNA synthetase	0.0023	0.0399	0.1769
Plasmodium vivax	hexose transporter	0.0102	0.2253	0.2253
Schistosoma mansoni	nuclear transcription factor X-box binding 1 (nfx1)	0.0014	0.0201	0.0894
Onchocerca volvulus		0.0014	0.0201	1
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0044	0.0911	0.4042
Plasmodium falciparum	proline--tRNA ligase	0.0036	0.0701	0.0701
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0031	0.0597	0.2648
Toxoplasma gondii	cell-cycle-associated protein kinase MAPK, putative	0.0164	0.3724	0.5632
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0142	0.0631
Schistosoma mansoni	ap endonuclease	0.0018	0.0295	0.1311
Trypanosoma cruzi	hexose transporter, putative	0.0032	0.0606	0.8651
Trichomonas vaginalis	sugar transporter, putative	0.0014	0.0201	0.0894
Entamoeba histolytica	hypothetical protein	0.0023	0.0399	0.6679

Activities

Activity type	Activity value	Assay description	Source	Reference
Kinact (binding)	= 25.4 nM	Inhibition of human cloned CA12 catalytic domain pre-incubated with enzyme for 15 mins by phenol red based CO2 hydration stopped-flow assay	ChEMBL.	25016228
Kinact (binding)	= 83.2 nM	Inhibition of human cloned CA9 catalytic domain pre-incubated with enzyme for 15 mins by phenol red based CO2 hydration stopped-flow assay	ChEMBL.	25016228
Kinact (binding)	= 243 nM	Inhibition of human cloned CA2 pre-incubated with enzyme for 15 mins by phenol red based CO2 hydration stopped-flow assay	ChEMBL.	25016228
Kinact (binding)	= 1715 nM	Inhibition of human cloned CA1 pre-incubated with enzyme for 15 mins by phenol red based CO2 hydration stopped-flow assay	ChEMBL.	25016228

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: CHEMBL3317550

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 921967