TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 419.387 | Formula: C17H14FN5O5S
H donors: 4 H acceptors: 6 LogP: 0.82 Rotable bonds: 9
Rule of 5 violations (Lipinski): 1
SMILES: O=C([C@H](Cc1c[nH]cn1)NC(=O)[C@H]1O[C@@H]1C(=O)O)Nc1nc2c(s1)cc(cc2)F
InChi: 1S/C17H14FN5O5S/c18-7-1-2-9-11(3-7)29-17(22-9)23-14(24)10(4-8-5-19-6-20-8)21-15(25)12-13(28-12)16(26)27/h1-3,5-6,10,12-13H,4H2,(H,19,20)(H,21,25)(H,26,27)(H,22,23,24)/t10-,12-,13-/m0/s1
InChiKey: BPOPGGCHEJPXQV-DRZSPHRISA-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	calpain 1, (mu/I) large subunit	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Loa Loa (eye worm)	calpain family protein 1	Get druggable targets OG5_127139	All targets in OG5_127139
Brugia malayi	calpain family protein 1	Get druggable targets OG5_127139	All targets in OG5_127139
Schistosoma japonicum	Calpain-A, putative	Get druggable targets OG5_127139	All targets in OG5_127139
Brugia malayi	calpain family protein 1	Get druggable targets OG5_127139	All targets in OG5_127139
Schistosoma mansoni	family C2 unassigned peptidase (C02 family)	Get druggable targets OG5_127139	All targets in OG5_127139
Echinococcus multilocularis	calpain A	Get druggable targets OG5_127139	All targets in OG5_127139
Schistosoma japonicum	Calpain-1 catalytic subunit, putative	Get druggable targets OG5_127139	All targets in OG5_127139
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_127139	All targets in OG5_127139
Schistosoma mansoni	family C2 unassigned peptidase (C02 family)	Get druggable targets OG5_127139	All targets in OG5_127139
Schistosoma japonicum	ko:K08585 calpain, invertebrate, putative	Get druggable targets OG5_127139	All targets in OG5_127139
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_127139	All targets in OG5_127139
Loa Loa (eye worm)	calpain family protein 1	Get druggable targets OG5_127139	All targets in OG5_127139
Echinococcus multilocularis	calpain family protein 1, d	Get druggable targets OG5_127139	All targets in OG5_127139
Schistosoma mansoni	family C2 unassigned peptidase (C02 family)	Get druggable targets OG5_127139	All targets in OG5_127139
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_127139	All targets in OG5_127139
Onchocerca volvulus		Get druggable targets OG5_127139	All targets in OG5_127139
Echinococcus granulosus	calpain A	Get druggable targets OG5_127139	All targets in OG5_127139
Echinococcus granulosus	family C2 unassigned peptidase C02 family	Get druggable targets OG5_127139	All targets in OG5_127139
Echinococcus multilocularis	family C2 unassigned peptidase (C02 family)	Get druggable targets OG5_127139	All targets in OG5_127139
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_127139	All targets in OG5_127139

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Echinococcus granulosus	calpain A	calpain 1, (mu/I) large subunit	714 aa	753 aa	31.7 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Trypanosoma brucei	cAMP-dependent protein kinase catalytic subunit 1	0.0154	0.0749	0.1282
Echinococcus granulosus	homeodomain interacting protein kinase 3	0.0556	0.3232	0.5516
Echinococcus granulosus	Vam6:Vps39 protein	0.0078	0.0282	0.0446
Toxoplasma gondii	calcium dependent protein kinase CDPK8	0.0036	0.0022	0.0038
Echinococcus multilocularis	family C2 unassigned peptidase (C02 family)	0.0069	0.0223	0.0346
Trypanosoma cruzi	casein kinase II, putative	0.0978	0.5841	1
Loa Loa (eye worm)	calpain family protein 1	0.0066	0.0205	0.0154
Onchocerca volvulus		0.0206	0.107	0.1024
Trichomonas vaginalis	conserved hypothetical protein	0.0163	0.0807	0.0115
Echinococcus granulosus	family C2 unassigned peptidase C02 family	0.0069	0.0223	0.0346
Schistosoma mansoni	hypothetical protein	0.0071	0.024	0.0374
Schistosoma mansoni	serine/threonine protein kinase	0.0483	0.278	0.474
Trichomonas vaginalis	adenylate cyclase, putative	0.0163	0.0807	0.0115
Toxoplasma gondii	cell-cycle-associated protein kinase GSK, putative	0.0178	0.0898	0.1538
Plasmodium vivax	serine/threonine kinase-1, putative	0.0217	0.1138	0.1948
Trichomonas vaginalis	adenylate and guanylate cyclases, putative	0.0163	0.0807	0.0115
Loa Loa (eye worm)	hypothetical protein	0.0099	0.041	0.036
Leishmania major	glycogen synthase kinase, putative;with=GeneDB:LinJ18_V3.0270	0.0178	0.0898	0.1538
Entamoeba histolytica	PH domain containing protein kinase, putative	0.0154	0.0749	0.1248
Trichomonas vaginalis	adenylate cyclase type VI, putative	0.0163	0.0807	0.0115
Echinococcus multilocularis	cAMP dependent protein kinase catalytic subunit	0.0154	0.0749	0.1248
Onchocerca volvulus		0.0453	0.2597	0.2559
Brugia malayi	cAMP-dependent protein kinase catalytic subunit, putative	0.0154	0.0749	0.0641
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0099	0.041	0.036
Schistosoma mansoni	serine/threonine protein kinase	0.0108	0.0465	0.0761
Toxoplasma gondii	AGC kinase	0.0154	0.0749	0.1282
Brugia malayi	Temporarily assigned gene name protein 59	0.0078	0.0282	0.0091
Plasmodium vivax	cAMP-dependent protein kinase catalytic subunit, putative	0.0154	0.0749	0.1282
Trichomonas vaginalis	guanylate cyclase, putative	0.0163	0.0807	0.0115
Trichomonas vaginalis	guanylate cyclase, putative	0.0163	0.0807	0.0115
Trichomonas vaginalis	hypothetical protein	0.0163	0.0807	0.0115
Trichomonas vaginalis	guanylate cyclase, putative	0.0163	0.0807	0.0115
Entamoeba histolytica	protein kinase domain containing protein	0.0178	0.0898	0.1506
Brugia malayi	hypothetical protein	0.0153	0.0743	0.0634
Trichomonas vaginalis	adenylate cyclase, putative	0.0163	0.0807	0.0115
Trichomonas vaginalis	adenylate cyclase type, putative	0.0163	0.0807	0.0115
Trypanosoma cruzi	Vacuolar sorting protein 39 domain 1/Vacuolar sorting protein 39 domain 2, putative	0.0078	0.0282	0.0483
Trichomonas vaginalis	adenylate cyclase type vIII, putative	0.0163	0.0807	0.0115
Trichomonas vaginalis	adenylate and guanylate cyclases, putative	0.0163	0.0807	0.0115
Schistosoma mansoni	serine/threonine protein kinase	0.0154	0.0749	0.1248
Trichomonas vaginalis	guanylate cyclase, putative	0.0163	0.0807	0.0115
Echinococcus granulosus	cyclin dependent kinase	0.0163	0.0804	0.1343
Loa Loa (eye worm)	hypothetical protein	0.0078	0.0282	0.0231
Echinococcus multilocularis	protein kinase shaggy	0.0178	0.0898	0.1506
Leishmania major	protein kinase, putative	0.0217	0.1138	0.1948
Schistosoma mansoni	serine/threonine protein kinase	0.0163	0.0804	0.1343
Trichomonas vaginalis	CMGC family protein kinase	0.0163	0.0804	0.0109
Trichomonas vaginalis	conserved hypothetical protein	0.0163	0.0807	0.0115
Giardia lamblia	Kinase, CMGC CK2	0.0978	0.5841	1
Trypanosoma cruzi	STE/STE11 serine/threonine-protein kinase, putative	0.0036	0.0022	0.0038
Loa Loa (eye worm)	CAMK/PIM protein kinase	0.0525	0.3043	0.3007
Echinococcus granulosus	protein kinase shaggy	0.0178	0.0898	0.1506
Mycobacterium ulcerans	1-deoxy-D-xylulose-5-phosphate synthase	0.0377	0.213	1
Loa Loa (eye worm)	STE/STE20/MSN protein kinase	0.0216	0.1133	0.1087
Trichomonas vaginalis	CMGC family protein kinase	0.0978	0.5841	1
Loa Loa (eye worm)	CMGC/CK2 protein kinase	0.0978	0.5841	0.582
Brugia malayi	aryl hydrocarbon receptor nuclear translocator protein, putative	0.0163	0.0807	0.071
Echinococcus multilocularis	cAMP dependent protein kinase catalytic subunit	0.0154	0.0749	0.1248
Plasmodium vivax	glycogen synthase kinase 3, putative	0.0178	0.0898	0.1538
Trichomonas vaginalis	adenylate cyclase, putative	0.0163	0.0807	0.0115
Loa Loa (eye worm)	hypothetical protein	0.0154	0.0749	0.0701
Echinococcus granulosus	cyclin dependent kinase 1	0.0163	0.0804	0.1343
Echinococcus multilocularis	calpain family protein 1, d	0.0048	0.0098	0.013
Entamoeba histolytica	hypothetical protein	0.0071	0.024	0.0374
Plasmodium vivax	unspecified product	0.0978	0.5841	1
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0099	0.041	0.0241
Plasmodium falciparum	protein kinase 5	0.0163	0.0804	0.1343
Trichomonas vaginalis	guanylate cyclase, putative	0.0163	0.0807	0.0115
Echinococcus granulosus	cyclin dependent kinase 5	0.0163	0.0804	0.1343
Loa Loa (eye worm)	transcription factor SMAD2	0.0237	0.1262	0.1217
Trypanosoma cruzi	kinetoplastid kinetochore protein 19, putative	0.0217	0.1138	0.1948
Loa Loa (eye worm)	hypothetical protein	0.0068	0.0216	0.0166
Leishmania major	protein kinase, putative	0.0036	0.0022	0.0038
Onchocerca volvulus		0.0178	0.0898	0.0851
Trichomonas vaginalis	conserved hypothetical protein	0.0163	0.0807	0.0115
Leishmania major	casein kinase II, putative	0.0978	0.5841	1
Echinococcus granulosus	casein kinase ii subunit alpha	0.0978	0.5841	1
Echinococcus granulosus	5'partial\|cyclin dependent kinase 1	0.0163	0.0804	0.1343
Schistosoma mansoni	voltage-gated potassium channel	0.0163	0.0807	0.1349
Trichomonas vaginalis	adenylate cyclase type, putative	0.0163	0.0807	0.0115
Trypanosoma cruzi	cAMP-dependent protein kinase catalytic subunit 1	0.0154	0.0749	0.1282
Trichomonas vaginalis	soluble guanylate cyclase gcy, putative	0.0163	0.0807	0.0115
Trypanosoma brucei	Vacuolar sorting protein 39 domain 1/Vacuolar sorting protein 39 domain 2, putative	0.0078	0.0282	0.0483
Entamoeba histolytica	casein kinase, putative	0.0978	0.5841	1
Trypanosoma cruzi	cAMP-dependent protein kinase catalytic subunit 2	0.0154	0.0749	0.1282
Loa Loa (eye worm)	AGC/DMPK/ROCK protein kinase	0.1439	0.8689	0.8682
Leishmania major	cell division related protein kinase 2,cdc2-related kinase	0.0163	0.0804	0.1376
Echinococcus granulosus	hypothetical protein	0.0187	0.0955	0.1602
Echinococcus multilocularis	casein kinase ii subunit alpha	0.0978	0.5841	1
Echinococcus granulosus	GTPase activating Rap:RanGAP domain 3	0.0078	0.0282	0.0446
Onchocerca volvulus	Serine\/threonine protein kinase homolog	0.0525	0.3043	0.3007
Onchocerca volvulus		0.0483	0.278	0.2743
Leishmania major	protein kinase A catalytic subunit	0.0154	0.0749	0.1282
Schistosoma mansoni	microtubule-associated protein tau	0.0698	0.411	0.7026
Trichomonas vaginalis	CMGC family protein kinase	0.0206	0.107	0.0631
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0099	0.041	0.0241
Trichomonas vaginalis	guanylate cyclase, putative	0.0163	0.0807	0.0115
Echinococcus granulosus	glycogen synthase kinase 3 beta	0.0178	0.0898	0.1506
Echinococcus multilocularis	cyclin dependent kinase 1	0.0163	0.0804	0.1343
Schistosoma mansoni	glutaminase	0.0277	0.1507	0.2551
Trichomonas vaginalis	adenylate cyclase type IX, putative	0.0163	0.0807	0.0115
Giardia lamblia	Kinase, CDC7	0.0206	0.107	0.0631
Echinococcus granulosus	cAMP dependent protein kinase catalytic subunit	0.0154	0.0749	0.1248
Brugia malayi	hypothetical protein	0.0071	0.024	0.0041
Echinococcus granulosus	rho-associated protein kinase 1	0.0483	0.278	0.474
Schistosoma mansoni	hypothetical protein	0.0078	0.0282	0.0446
Schistosoma mansoni	glycogen synthase kinase 3-related (gsk3) (cmgc group III)	0.0178	0.0898	0.1506
Loa Loa (eye worm)	hypothetical protein	0.0078	0.0282	0.0231
Schistosoma mansoni	protein kinase	0.0216	0.1133	0.1909
Trichomonas vaginalis	adenylate cyclase, putative	0.0163	0.0807	0.0115
Loa Loa (eye worm)	STE/STE20/KHS protein kinase	0.0108	0.0465	0.0416
Trypanosoma brucei	kinetoplastid kinetochore protein 10	0.0217	0.1138	0.1948
Plasmodium falciparum	cAMP-dependent protein kinase catalytic subunit	0.0154	0.0749	0.1248
Echinococcus multilocularis	glycogen synthase kinase 3 beta	0.0178	0.0898	0.1506
Echinococcus granulosus	cAMP dependent protein kinase catalytic subunit	0.0154	0.0749	0.1248
Echinococcus multilocularis	proto oncogene serine:threonine protein kinase	0.0525	0.3043	0.5192
Schistosoma mansoni	mitogen-activated protein kinase kinase kinase 3 mapkkk3 mekk3	0.0078	0.0282	0.0446
Trichomonas vaginalis	conserved hypothetical protein	0.0163	0.0807	0.0115
Trichomonas vaginalis	adenylate cyclase, putative	0.0163	0.0807	0.0115
Trichomonas vaginalis	adenylate and guanylate cyclases, putative	0.0163	0.0807	0.0115
Echinococcus granulosus	microtubule associated protein 2	0.0698	0.411	0.7026
Trichomonas vaginalis	CMGC family protein kinase	0.0178	0.0898	0.0294
Trichomonas vaginalis	soluble guanylate cyclase gcy, putative	0.0163	0.0807	0.0115
Schistosoma mansoni	rap gtpase-activating protein	0.0078	0.0282	0.0446
Trypanosoma brucei	STE/STE11 serine/threonine-protein kinase, putative	0.0036	0.0022	0.0038
Onchocerca volvulus		0.0153	0.0743	0.0695
Trichomonas vaginalis	guanylate cyclase, putative	0.0163	0.0807	0.0115
Echinococcus granulosus	calpain A	0.0069	0.0223	0.0346
Brugia malayi	Homeodomain interacting protein kinase protein 1	0.0556	0.3232	0.3568
Leishmania major	cell division protein kinase 2,cdc2-related kinase	0.0163	0.0804	0.1376
Trichomonas vaginalis	adenylate cyclase, putative	0.0163	0.0807	0.0115
Onchocerca volvulus		0.0206	0.107	0.1024
Trichomonas vaginalis	adenylate cyclase type IX, putative	0.0163	0.0807	0.0115
Trichomonas vaginalis	adenylate cyclase, putative	0.0163	0.0807	0.0115
Loa Loa (eye worm)	hypothetical protein	0.0048	0.0098	0.0046
Trypanosoma cruzi	Vacuolar sorting protein 39 domain 1/Vacuolar sorting protein 39 domain 2, putative	0.0078	0.0282	0.0483
Schistosoma mansoni	voltage-gated potassium channel	0.0163	0.0807	0.1349
Schistosoma mansoni	mitogen-activated protein kinase kinase kinase 3 mapkkk3 mekk3	0.0078	0.0282	0.0446
Trypanosoma cruzi	glycogen synthase kinase 3, putative	0.0178	0.0898	0.1538
Trichomonas vaginalis	adenylate cyclase type III, putative	0.0163	0.0807	0.0115
Toxoplasma gondii	CMGC kinase, CK2 family	0.0978	0.5841	1
Treponema pallidum	1-deoxy-D-xylulose-5-phosphate synthase	0.0377	0.213	0.5
Trichomonas vaginalis	adenylate and guanylate cyclases, putative	0.0163	0.0807	0.0115
Trypanosoma brucei	cdc2-related kinase 3	0.0163	0.0804	0.1376
Trichomonas vaginalis	adenylate and guanylate cyclases, putative	0.0163	0.0807	0.0115
Entamoeba histolytica	protein kinase, putative	0.0047	0.0089	0.0114
Loa Loa (eye worm)	CMGC/CDK/CDC2 protein kinase	0.0163	0.0804	0.0756
Entamoeba histolytica	protein kinase domain containing protein	0.0556	0.3232	0.5516
Trypanosoma brucei	kinetoplastid kinetochore protein 19	0.0217	0.1138	0.1948
Entamoeba histolytica	hypothetical protein	0.0071	0.024	0.0374
Echinococcus multilocularis		0.0216	0.1133	0.1909
Toxoplasma gondii	protein kinase, cAMP-dependent, catalytic chain	0.0154	0.0749	0.1282
Trypanosoma cruzi	STE/STE11 serine/threonine-protein kinase, putative	0.0036	0.0022	0.0038
Trypanosoma brucei	cdc2-related kinase 1	0.0163	0.0804	0.1376
Echinococcus multilocularis	mitogen activated protein kinase kinase kinase	0.0108	0.0465	0.0761
Trichomonas vaginalis	soluble guanylate cyclase gcy, putative	0.0163	0.0807	0.0115
Schistosoma mansoni	protein kinase	0.0294	0.1616	0.2739
Trichomonas vaginalis	intestinal guanylate cyclase, putative	0.0163	0.0807	0.0115
Trichomonas vaginalis	guanylate cyclase, putative	0.0163	0.0807	0.0115
Loa Loa (eye worm)	hypothetical protein	0.0265	0.1433	0.1389
Schistosoma mansoni	protein kinase	0.0978	0.5841	1
Giardia lamblia	Kinase, CMGC CDK	0.0163	0.0804	0.0109
Brugia malayi	Protein kinase domain containing protein	0.0108	0.0465	0.0306
Brugia malayi	intracellular kinase	0.0178	0.0898	0.0817
Schistosoma mansoni	family C2 unassigned peptidase (C02 family)	0.0069	0.0223	0.0346
Entamoeba histolytica	cell division protein kinase 2, putative	0.0163	0.0804	0.1343
Echinococcus multilocularis	cyclin dependent kinase	0.0163	0.0804	0.1343
Trichomonas vaginalis	CMGC family protein kinase	0.0978	0.5841	1
Trichomonas vaginalis	glutaminase, putative	0.0277	0.1507	0.1488
Trichomonas vaginalis	adenylyl cyclase type V, putative	0.0163	0.0807	0.0115
Trichomonas vaginalis	guanylate cyclase, putative	0.0163	0.0807	0.0115
Trypanosoma cruzi	cAMP-dependent protein kinase catalytic subunit 3	0.0154	0.0749	0.1282
Trichomonas vaginalis	adenylate cyclase, putative	0.0163	0.0807	0.0115
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0071	0.024	0.0374
Onchocerca volvulus		0.0078	0.0282	0.0231
Brugia malayi	hypothetical protein	0.0078	0.0282	0.0091
Trichomonas vaginalis	CMGC family protein kinase	0.0978	0.5841	1
Trichomonas vaginalis	conserved hypothetical protein	0.0163	0.0807	0.0115
Brugia malayi	Protein kinase domain containing protein	0.0206	0.107	0.1019
Trichomonas vaginalis	CMGC family protein kinase	0.0978	0.5841	1
Echinococcus multilocularis	voltage gated potassium channel	0.0163	0.0807	0.1349
Schistosoma mansoni	voltage-gated potassium channel	0.0163	0.0807	0.1349
Trichomonas vaginalis	guanylate cyclase, putative	0.0163	0.0807	0.0115
Trichomonas vaginalis	adenylate and guanylate cyclases, putative	0.0163	0.0807	0.0115
Schistosoma mansoni	family C2 unassigned peptidase (C02 family)	0.0069	0.0223	0.0346
Trichomonas vaginalis	adenylate cyclase, putative	0.0163	0.0807	0.0115
Schistosoma mansoni	family C2 unassigned peptidase (C02 family)	0.0066	0.0205	0.0314
Trichomonas vaginalis	CMGC family protein kinase	0.0163	0.0804	0.0109
Brugia malayi	glutaminase DH11.1	0.0277	0.1507	0.1534
Plasmodium falciparum	casein kinase 2, alpha subunit	0.0978	0.5841	1
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.0163	0.0807	0.1349
Brugia malayi	cell division control protein 2 homolog	0.0163	0.0804	0.0706
Trichomonas vaginalis	guanylate cyclase, putative	0.0163	0.0807	0.0115
Trypanosoma brucei	cAMP-dependent protein kinase catalytic subunit 2	0.0154	0.0749	0.1282
Trichomonas vaginalis	guanylate cyclase, putative	0.0163	0.0807	0.0115
Trichomonas vaginalis	conserved hypothetical protein	0.0163	0.0807	0.0115
Loa Loa (eye worm)	MH2 domain-containing protein	0.0237	0.1262	0.1217
Echinococcus multilocularis	GTPase activating Rap:RanGAP domain 3	0.0078	0.0282	0.0446
Trichomonas vaginalis	adenylate cyclase, putative	0.0163	0.0807	0.0115
Plasmodium falciparum	1-deoxy-D-xylulose 5-phosphate synthase	0.0377	0.213	0.3622
Giardia lamblia	Kinase, CMGC CLK	0.0217	0.1138	0.0764
Trichomonas vaginalis	adenylate cyclase, putative	0.0163	0.0807	0.0115
Schistosoma mansoni	serine/threonine protein kinase	0.0217	0.1138	0.1917
Trypanosoma cruzi	cdc2-related kinase 1	0.0163	0.0804	0.1376
Schistosoma mansoni	transcription factor LCR-F1	0.0071	0.024	0.0374
Echinococcus multilocularis	CDC7 cell division cycle 7	0.0206	0.107	0.18
Loa Loa (eye worm)	hypothetical protein	0.0058	0.0159	0.0108
Trichomonas vaginalis	conserved hypothetical protein	0.0163	0.0807	0.0115
Schistosoma mansoni	serine/threonine protein kinase	0.0556	0.3232	0.5516
Trichomonas vaginalis	CMGC family protein kinase	0.0978	0.5841	1
Schistosoma mansoni	serine/threonine protein kinase	0.0108	0.0465	0.0761
Plasmodium falciparum	protein serine/threonine kinase-1	0.0217	0.1138	0.1917
Loa Loa (eye worm)	hypothetical protein	0.0187	0.0955	0.0908
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0071	0.024	0.0374
Entamoeba histolytica	hypothetical protein	0.0071	0.024	0.0374
Mycobacterium tuberculosis	Probable 1-deoxy-D-xylulose 5-phosphate synthase Dxs1 (1-deoxyxylulose-5-phosphate synthase) (DXP synthase) (DXPS)	0.0377	0.213	0.5
Loa Loa (eye worm)	hypothetical protein	0.0163	0.0807	0.076
Schistosoma mansoni	serine/threonine protein kinase	0.0154	0.0749	0.1248
Plasmodium vivax	1-deoxy-D-xylulose 5-phosphate synthase, putative	0.0377	0.213	0.3646
Plasmodium vivax	casein kinase 2, alpha subunit, putative	0.0978	0.5841	1
Brugia malayi	Voltage-gated potassium channel, EAG (KCNH1)-related. C. elegans egl-2 ortholog	0.0163	0.0807	0.071
Echinococcus multilocularis	dual specificity protein kinase clk2	0.0217	0.1138	0.1917
Loa Loa (eye worm)	hypothetical protein	0.0133	0.0621	0.0572
Echinococcus multilocularis	cyclin dependent kinase 5	0.0163	0.0804	0.1343
Trichomonas vaginalis	CMGC family protein kinase	0.0978	0.5841	1
Echinococcus granulosus	protein kinase	0.0216	0.1133	0.1909
Echinococcus granulosus	mitogen activated protein kinase kinase kinase	0.0108	0.0465	0.0761
Trichomonas vaginalis	adenylate cyclase, putative	0.0163	0.0807	0.0115
Trypanosoma cruzi	kinetoplastid kinetochore protein 19, putative	0.0217	0.1138	0.1948
Trichomonas vaginalis	guanylate cyclase beta 1 subunit, putative	0.0163	0.0807	0.0115
Schistosoma mansoni	serine/threonine protein kinase	0.0163	0.0804	0.1343
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.0163	0.0807	0.1349
Entamoeba histolytica	hypothetical protein	0.0071	0.024	0.0374
Entamoeba histolytica	protein kinase domain containing protein	0.0178	0.0898	0.1506
Entamoeba histolytica	cell division protein kinase 2, putative	0.0163	0.0804	0.1343
Schistosoma mansoni	serine/threonine protein kinase	0.0217	0.1138	0.1917
Schistosoma mansoni	protein kinase	0.0108	0.0465	0.0761
Plasmodium falciparum	glycogen synthase kinase 3	0.0178	0.0898	0.1506
Trichomonas vaginalis	adenylate cyclase type, putative	0.0163	0.0807	0.0115
Trypanosoma brucei	protein kinase A catalytic subunit, putative	0.0154	0.0749	0.1282
Echinococcus multilocularis	serine:threonine protein kinase MRCK beta	0.0108	0.0465	0.0761
Leishmania major	protein kinase A catalytic subunit isoform 2	0.0154	0.0749	0.1282
Trichomonas vaginalis	adenylate cyclase, putative	0.0163	0.0807	0.0115
Entamoeba histolytica	protein kinase, putative	0.0178	0.0898	0.1506
Trypanosoma cruzi	cdc2-related kinase 3	0.0163	0.0804	0.1376
Brugia malayi	Casein kinase II, alpha chain	0.0978	0.5841	0.6643
Trichomonas vaginalis	adenylate cyclase type IX, putative	0.0163	0.0807	0.0115
Trichomonas vaginalis	guanylate cyclase, putative	0.0163	0.0807	0.0115
Loa Loa (eye worm)	glutaminase 2	0.0277	0.1507	0.1462
Trichomonas vaginalis	CMGC family protein kinase	0.0978	0.5841	1
Echinococcus granulosus	cAMP dependent protein kinase catalytic subunit	0.0154	0.0749	0.1248
Schistosoma mansoni	serine/threonine protein kinase	0.0525	0.3043	0.5192
Echinococcus multilocularis	enhancer of mRNA decapping protein 4	0.0124	0.0566	0.0933
Brugia malayi	Serine/threonine-protein kinase Pim-3	0.0525	0.3043	0.3345
Echinococcus granulosus	single minded 2	0.0163	0.0807	0.1349
Echinococcus multilocularis		0.0187	0.0955	0.1602
Trichomonas vaginalis	CMGC family protein kinase	0.0217	0.1138	0.0764
Loa Loa (eye worm)	calpain family protein 1	0.0048	0.0098	0.0046
Loa Loa (eye worm)	glutaminase	0.0277	0.1507	0.1462
Trichomonas vaginalis	adenylate and guanylate cyclases, putative	0.0163	0.0807	0.0115
Trichomonas vaginalis	guanylate cyclase, putative	0.0163	0.0807	0.0115
Trichomonas vaginalis	CMGC family protein kinase	0.0206	0.107	0.0631
Echinococcus multilocularis	cAMP dependent protein kinase catalytic subunit	0.0154	0.0749	0.1248
Mycobacterium leprae	PROBABLE 1-DEOXY-D-XYLULOSE 5-PHOSPHATE SYNTHASE DXS1 (1-DEOXYXYLULOSE-5-PHOSPHATE SYNTHASE) (DXP SYNTHASE) (DXPS)	0.0377	0.213	1
Loa Loa (eye worm)	CMGC/CDK/CDK5 protein kinase	0.0163	0.0804	0.0756
Loa Loa (eye worm)	CMGC/CDK/CDC2 protein kinase	0.0163	0.0804	0.0756
Trichomonas vaginalis	conserved hypothetical protein	0.0163	0.0807	0.0115
Brugia malayi	Protein kinase domain containing protein	0.1439	0.8689	1
Echinococcus multilocularis	calpain A	0.0069	0.0223	0.0346
Echinococcus granulosus	mitogen activated protein kinase kinase kinase	0.0108	0.0465	0.0761
Schistosoma mansoni	hypothetical protein	0.0163	0.0807	0.1349
Trypanosoma cruzi	kinetoplastid kinetochore protein 10, putative	0.0217	0.1138	0.1948
Onchocerca volvulus		0.1651	1	1
Loa Loa (eye worm)	CMGC/CLK protein kinase	0.0217	0.1138	0.1092
Trichomonas vaginalis	conserved hypothetical protein	0.0163	0.0807	0.0115
Loa Loa (eye worm)	AGC/PKA protein kinase	0.0154	0.0749	0.0701
Schistosoma mansoni	hypothetical protein	0.0068	0.0216	0.0334
Leishmania major	protein kinase A catalytic subunit isoform 1	0.0154	0.0749	0.1282
Brugia malayi	Protein kinase domain containing protein	0.0163	0.0804	0.0706
Trichomonas vaginalis	adenylate and guanylate cyclases, putative	0.0163	0.0807	0.0115
Trichomonas vaginalis	CMGC family protein kinase	0.0163	0.0804	0.0109
Trichomonas vaginalis	adenylate and guanylate cyclases, putative	0.0163	0.0807	0.0115
Trichomonas vaginalis	guanylate cyclase, putative	0.0163	0.0807	0.0115
Loa Loa (eye worm)	hypothetical protein	0.0153	0.0743	0.0695
Loa Loa (eye worm)	CMGC/GSK protein kinase	0.0178	0.0898	0.0851
Entamoeba histolytica	protein kinase domain containing protein	0.0978	0.5841	1
Trichomonas vaginalis	guanylate cyclase beta 2 subunit, putative	0.0163	0.0807	0.0115
Trichomonas vaginalis	guanylate cyclase, putative	0.0163	0.0807	0.0115
Trichomonas vaginalis	guanylate cyclase, putative	0.0163	0.0807	0.0115
Schistosoma mansoni	60S ribosomal protein L21	0.0163	0.0807	0.1349
Brugia malayi	Protein kinase domain containing protein	0.0217	0.1138	0.1099
Brugia malayi	probable protein kinase	0.0294	0.1616	0.1663
Schistosoma mansoni	voltage-gated potassium channel	0.0163	0.0807	0.1349
Loa Loa (eye worm)	hypothetical protein	0.0066	0.0205	0.0154
Schistosoma mansoni	vam6/vps39 related	0.0078	0.0282	0.0446
Echinococcus multilocularis	microtubule associated protein 2	0.0698	0.411	0.7026
Trypanosoma brucei	protein kinase, putative	0.0036	0.0022	0.0038
Echinococcus multilocularis	mitogen activated protein kinase kinase kinase	0.0108	0.0465	0.0761
Toxoplasma gondii	cell-cycle-associated protein kinase CLK, putative	0.0217	0.1138	0.1948
Giardia lamblia	Kinase, CMGC CDK	0.0163	0.0804	0.0109
Loa Loa (eye worm)	AGC/PKA protein kinase	0.0154	0.0749	0.0701
Trypanosoma cruzi	cdc2-related kinase 3	0.0163	0.0804	0.1376
Echinococcus multilocularis	cyclin dependent kinase 1	0.0163	0.0804	0.1343
Echinococcus multilocularis	homeodomain interacting protein kinase 3	0.0556	0.3232	0.5516
Loa Loa (eye worm)	hypothetical protein	0.0078	0.0282	0.0231
Trypanosoma cruzi	cAMP-dependent protein kinase catalytic subunit 3	0.0154	0.0749	0.1282
Trichomonas vaginalis	CMGC family protein kinase	0.0178	0.0898	0.0294
Loa Loa (eye worm)	CMGC/GSK protein kinase	0.0178	0.0898	0.0851
Echinococcus granulosus	Serine/threonine-protein kinase Genghis Khan	0.0108	0.0465	0.0761
Plasmodium vivax	protein kinase Crk2	0.0163	0.0804	0.1376
Trichomonas vaginalis	adenylate cyclase type III, putative	0.0163	0.0807	0.0115
Loa Loa (eye worm)	CDC7 protein kinase	0.0206	0.107	0.1024
Leishmania major	protein kinase, putative	0.0217	0.1138	0.1948
Trichomonas vaginalis	conserved hypothetical protein	0.0163	0.0807	0.0115
Trypanosoma cruzi	kinetoplastid kinetochore protein 10, putative	0.0217	0.1138	0.1948
Echinococcus granulosus	CDC7 cell division cycle 7	0.0206	0.107	0.18
Echinococcus multilocularis	rho associated protein kinase	0.0483	0.278	0.474
Echinococcus granulosus	voltage gated potassium channel	0.0163	0.0807	0.1349
Echinococcus granulosus	serine:threonine protein kinase mig 15	0.0265	0.1433	0.2425
Schistosoma mansoni	serine/threonine protein kinase	0.0154	0.0749	0.1248
Echinococcus granulosus	dual specificity protein kinase clk2	0.0217	0.1138	0.1917
Trypanosoma brucei	STE group serine/threonine-protein kinase, putative	0.0193	0.099	0.1696
Trichomonas vaginalis	soluble guanylate cyclase gcy, putative	0.0163	0.0807	0.0115
Trichomonas vaginalis	CMGC family protein kinase	0.0206	0.107	0.0631
Echinococcus granulosus	proto oncogene serine:threonine protein kinase	0.0525	0.3043	0.5192
Trichomonas vaginalis	guanylate cyclase, putative	0.0163	0.0807	0.0115
Brugia malayi	Protein kinase domain containing protein	0.0525	0.3043	0.3345
Toxoplasma gondii	AGC kinase	0.0154	0.0749	0.1282
Chlamydia trachomatis	1-deoxy-D-xylulose-5-phosphate synthase	0.0377	0.213	0.5
Entamoeba histolytica	PH domain containing protein kinase, putative	0.0154	0.0749	0.1248
Toxoplasma gondii	cell-cycle-associated protein kinase CDK, putative	0.0163	0.0804	0.1376
Trypanosoma cruzi	cdc2-related kinase 1	0.0163	0.0804	0.1376
Brugia malayi	latrophilin 2 splice variant baaae	0.0068	0.0216	0.0013
Schistosoma mansoni	serine/threonine protein kinase	0.0206	0.107	0.18
Trichomonas vaginalis	adenylate cyclase, putative	0.0163	0.0807	0.0115
Trichomonas vaginalis	guanylate cyclase, putative	0.0163	0.0807	0.0115
Giardia lamblia	Kinase, CMGC GSK	0.0178	0.0898	0.0294
Brugia malayi	MH2 domain containing protein	0.0237	0.1262	0.1246
Toxoplasma gondii	1-deoxy-D-xylulose-5-phosphate synthase	0.0377	0.213	0.3646
Trypanosoma brucei	Casein kinase II	0.0978	0.5841	1
Loa Loa (eye worm)	CMGC/DYRK/HIPK protein kinase	0.0556	0.3232	0.3197
Schistosoma mansoni	voltage-gated potassium channel	0.0163	0.0807	0.1349
Trichomonas vaginalis	adenylate cyclase type IX, putative	0.0163	0.0807	0.0115
Trichomonas vaginalis	soluble guanylate cyclase gcy, putative	0.0163	0.0807	0.0115
Trypanosoma brucei	protein kinase, putative	0.0178	0.0898	0.1538
Echinococcus granulosus	enhancer of mRNA decapping protein 4	0.0124	0.0566	0.0933
Trichomonas vaginalis	guanylate cyclase, putative	0.0163	0.0807	0.0115
Echinococcus multilocularis	cAMP dependent protein kinase catalytic subunit	0.0154	0.0749	0.1248
Giardia lamblia	Kinase, CMGC GSK	0.0178	0.0898	0.0294
Loa Loa (eye worm)	CAMK/PIM protein kinase	0.0525	0.3043	0.3007

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 530 nM	Inhibition of human erythrocyte full length Cal1 using (DABCYL)TPLK-SPPSPR-(EDANS) as substrate after 20 min by FRET assay	ChEMBL.	23834438
IC50 (binding)	> 1000 nM	Inhibition FRET Assay	BINDINGDB.	No reference

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: CHEMBL2408914

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1773713