TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 467.522 | Formula: C26H25N7O2
H donors: 4 H acceptors: 4 LogP: 3.61 Rotable bonds: 7
Rule of 5 violations (Lipinski): 1
SMILES: COc1cc2[nH]ncc2cc1Nc1ncnc2c1c1CC(CCc1[nH]2)C(=O)NCc1ccccc1
InChi: 1S/C26H25N7O2/c1-35-22-11-20-17(13-30-33-20)10-21(22)32-25-23-18-9-16(7-8-19(18)31-24(23)28-14-29-25)26(34)27-12-15-5-3-2-4-6-15/h2-6,10-11,13-14,16H,7-9,12H2,1H3,(H,27,34)(H,30,33)(H2,28,29,31,32)
InChiKey: ZVTOPUTUABIMNX-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	MAP kinase interacting serine/threonine kinase 1	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Brugia malayi	Protein kinase domain containing protein	Get druggable targets OG5_131958	All targets in OG5_131958
Loa Loa (eye worm)	camk/mapkapk/mnk protein kinase	Get druggable targets OG5_131958	All targets in OG5_131958

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	Phosphatidylinositol 3-kinase tor1	0.0056	0.0567	0.0395
Entamoeba histolytica	peptidyl-prolyl cis-trans isomerase, FKBP-type, putative	0.0063	0.0699	0.0407
Mycobacterium ulcerans	FK-506 binding protein, peptidyl-prolyl cis-trans isomerase	0.0063	0.0699	0.5
Schistosoma mansoni	cathepsin F (C01 family)	0.0566	1	1
Trichomonas vaginalis	conserved hypothetical protein	0.0115	0.1653	0.1551
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0566	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0566	1	1
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0297	0.5037	0.4881
Entamoeba histolytica	cysteine protease, putative	0.0115	0.1653	0.1391
Schistosoma mansoni	subfamily C1A non-peptidase homologue (C01 family)	0.0115	0.1653	0.1391
Trypanosoma cruzi	target of rapamycin kinase 3	0.0045	0.037	0.0194
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0045	0.0369	0.0252
Brugia malayi	cahepsin L-like non-peptiedase homolog	0.0115	0.1653	0.1391
Trypanosoma cruzi	cysteine peptidase, putative	0.0566	1	1
Entamoeba histolytica	cysteine protease, putative	0.0297	0.5037	0.4881
Trichomonas vaginalis	Clan CA, family C1, cathepsin L, S or H-like cysteine peptidase	0.0115	0.1653	0.1551
Leishmania major	target of rapamycin (TOR) kinase 2, putative	0.0056	0.0567	0.0205
Trypanosoma cruzi	cysteine proteinase, putative	0.0297	0.5037	0.4946
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0082	0.1049	0.0941
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0039	0.0248	0.0129
Echinococcus granulosus	cathepsin l cysteine peptidase	0.0566	1	1
Schistosoma mansoni	immunophilin	0.0063	0.0699	0.0407
Plasmodium vivax	vivapain-3	0.0297	0.5037	0.4664
Leishmania major	cathepsin L-like protease	0.0566	1	1
Toxoplasma gondii	cathepsin CPC1	0.0115	0.1653	0.1378
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0115	0.1653	0.1551
Brugia malayi	cathepsin L-like cysteine proteinase, identical	0.0183	0.2918	0.2696
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0035	0.0177	0.0057
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0566	1	1
Entamoeba histolytica	cysteine proteinase, putative	0.0297	0.5037	0.4881
Giardia lamblia	Dipeptidyl-peptidase I precursor	0.0115	0.1653	0.4051
Entamoeba histolytica	cysteine proteinase, putative	0.0383	0.6616	0.651
Leishmania major	cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like	0.0238	0.3945	0.3713
Plasmodium vivax	serine-repeat antigen (SERA)	0.0115	0.1653	0.1025
Entamoeba histolytica	cysteine protease, putative	0.0115	0.1653	0.1391
Entamoeba histolytica	hypothetical protein	0.0094	0.128	0.1006
Loa Loa (eye worm)	hypothetical protein	0.004	0.0279	0.0102
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0034	0.0171	0.0052
Brugia malayi	Cathepsin L-like precursor	0.0383	0.6616	0.651
Plasmodium falciparum	serine repeat antigen 9	0.0115	0.1653	0.1025
Echinococcus multilocularis	phosphatidylinositol 4 phosphate 3 kinase C2	0.0077	0.0967	0.0452
Giardia lamblia	Cathepsin L-like protease	0.0115	0.1653	0.4051
Entamoeba histolytica	cysteine protease, putative	0.0297	0.5037	0.4881
Leishmania major	cathepsin L-like protease	0.0566	1	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0032	0.0121	0.0001
Entamoeba histolytica	cysteine protease, putative	0.0297	0.5037	0.4881
Plasmodium vivax	unspecified product	0.0183	0.2918	0.2386
Loa Loa (eye worm)	hypothetical protein	0.0115	0.1653	0.15
Loa Loa (eye worm)	hypothetical protein	0.0383	0.6616	0.6554
Loa Loa (eye worm)	hypothetical protein	0.0183	0.2918	0.2789
Brugia malayi	Cathepsin L-like precursor	0.0383	0.6616	0.651
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0042	0.0319	0.0201
Giardia lamblia	Cysteine protease	0.0115	0.1653	0.4051
Echinococcus multilocularis	cathepsin b	0.0515	0.9065	0.9012
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0042	0.0304	0.0186
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0566	1	1
Brugia malayi	cathepsin Z-like cysteine proteinase	0.0115	0.1653	0.1391
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0566	1	1
Plasmodium vivax	serine-repeat antigen (SERA)	0.0115	0.1653	0.1025
Entamoeba histolytica	cysteine protease, putative	0.0297	0.5037	0.4881
Plasmodium falciparum	dipeptidyl aminopeptidase 2	0.0115	0.1653	0.1025
Brugia malayi	fibroinase precursor	0.0115	0.1653	0.1391
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0566	1	1
Brugia malayi	cathepsin F-like cysteine proteinase	0.0115	0.1653	0.1391
Onchocerca volvulus		0.0383	0.6616	0.5946
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0566	1	1
Entamoeba histolytica	cysteine protease, putative	0.0297	0.5037	0.4881
Giardia lamblia	Hypothetical protein	0.0115	0.1653	0.4051
Echinococcus multilocularis	cysteine protease	0.0566	1	1
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.0238	0.3945	0.3835
Toxoplasma gondii	cathepsin CPL	0.0566	1	1
Trypanosoma cruzi	phosphatidylinositol 3-kinase vps34-like	0.0042	0.0304	0.0128
Plasmodium vivax	dipeptidyl aminopeptidase 2, putative	0.0115	0.1653	0.1025
Entamoeba histolytica	cysteine protease, putative	0.0566	1	1
Giardia lamblia	Cathepsin B precursor	0.0238	0.3945	1
Onchocerca volvulus		0.0566	1	1
Plasmodium vivax	dipeptidyl aminopeptidase 1, putative	0.0115	0.1653	0.1025
Plasmodium falciparum	serine repeat antigen 2	0.0115	0.1653	0.1025
Entamoeba histolytica	FKBP-rapamycin associated protein (FRAP), putative	0.0056	0.0567	0.0271
Entamoeba histolytica	phosphatidylinositol3-kinaseTor2, putative	0.0056	0.0567	0.0271
Brugia malayi	Papain family cysteine protease containing protein	0.0297	0.5037	0.4881
Brugia malayi	Papain family cysteine protease containing protein	0.0566	1	1
Brugia malayi	Protein kinase domain containing protein	0.05	0.8777	0.8739
Loa Loa (eye worm)	FKBP5 protein	0.0063	0.0699	0.053
Loa Loa (eye worm)	cysteine proteinase cathepsin Z	0.0115	0.1653	0.15
Entamoeba histolytica	cysteine protease, putative	0.0297	0.5037	0.4881
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0566	1	1
Echinococcus granulosus	cathepsin b	0.0515	0.9065	0.9012
Leishmania major	cysteine peptidase A (CPA)	0.0566	1	1
Entamoeba histolytica	cysteine proteinase, putative	0.0297	0.5037	0.4881
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0566	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0297	0.5037	0.5037
Plasmodium falciparum	serine repeat antigen 1	0.0115	0.1653	0.1025
Plasmodium vivax	vivapain-1	0.0297	0.5037	0.4664
Toxoplasma gondii	cathepsin CPC2	0.0115	0.1653	0.1378
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0515	0.9065	0.9036
Onchocerca volvulus	Cathepsin L homolog	0.0566	1	1
Brugia malayi	cathepsin L precursor	0.0115	0.1653	0.1391
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.0118	0.1712	0.1561
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0566	1	1
Plasmodium falciparum	dipeptidyl aminopeptidase 3	0.0115	0.1653	0.1025
Entamoeba histolytica	cysteine protease, putative	0.0297	0.5037	0.4881
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0566	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or H-like cysteine peptidase	0.0115	0.1653	0.1551
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0056	0.0567	0.0453
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0115	0.1653	0.1551
Trypanosoma cruzi	cysteine peptidase, putative	0.0566	1	1
Brugia malayi	Papain family cysteine protease containing protein	0.0115	0.1653	0.1391
Trypanosoma cruzi	peptidyl-prolyl cis-trans isomerase, putative	0.0063	0.0699	0.053
Brugia malayi	Cathepsin L-like precursor	0.0566	1	1
Plasmodium falciparum	serine repeat antigen 7	0.0115	0.1653	0.1025
Plasmodium falciparum	serine repeat antigen 5	0.0115	0.1653	0.1025
Giardia lamblia	Cysteine protease	0.0115	0.1653	0.4051
Giardia lamblia	GTOR	0.0056	0.0567	0.1235
Brugia malayi	Papain family cysteine protease containing protein	0.0115	0.1653	0.1391
Trypanosoma cruzi	cruzipain precursor, putative	0.0566	1	1
Giardia lamblia	Cathepsin B-like cysteine proteinase 3 precursor	0.0115	0.1653	0.4051
Giardia lamblia	Cathepsin B precursor	0.0115	0.1653	0.4051
Trypanosoma cruzi	cysteine peptidase (N-terminal), putative	0.0297	0.5037	0.4946
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0566	1	1
Giardia lamblia	Cysteine protease	0.0115	0.1653	0.4051
Plasmodium falciparum	serine repeat antigen 4	0.0115	0.1653	0.1025
Trypanosoma brucei	phosphatidylinositol 3-kinase tor, putative	0.0028	0.0056	0.0056
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0032	0.0121	0.0001
Giardia lamblia	Cathepsin L precursor	0.0115	0.1653	0.4051
Brugia malayi	FKBP-type peptidyl-prolyl cis-trans isomerase-12, BmFKBP-12	0.0063	0.0699	0.0407
Echinococcus granulosus	cathepsin L cysteine proteinase	0.0566	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0566	1	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0056	0.0567	0.0453
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0566	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0566	1	1
Loa Loa (eye worm)	hypothetical protein	0.0115	0.1653	0.15
Giardia lamblia	Cathepsin L precursor	0.0115	0.1653	0.4051
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0566	1	1
Trichomonas vaginalis	peptidylprolyl isomerase, putative	0.0063	0.0699	0.0586
Brugia malayi	cathepsin B-like cysteine proteinase	0.0515	0.9065	0.9036
Echinococcus granulosus	phosphatidylinositol 4 phosphate 3 kinase C2	0.0077	0.0967	0.0452
Loa Loa (eye worm)	camk/mapkapk/mnk protein kinase	0.05	0.8777	0.8755
Trypanosoma cruzi	cysteine peptidase, putative	0.0566	1	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0048	0.0425	0.0309
Plasmodium vivax	serine-repeat antigen (SERA), putative	0.0115	0.1653	0.1025
Echinococcus granulosus	cathepsin b	0.0515	0.9065	0.9012
Entamoeba histolytica	hypothetical protein	0.0115	0.1653	0.1391
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0566	1	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0566	1	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0045	0.0369	0.0252
Giardia lamblia	Cathepsin L precursor	0.0115	0.1653	0.4051
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0566	1	1
Giardia lamblia	Cathepsin L precursor	0.0115	0.1653	0.4051
Trichomonas vaginalis	Clan CA, family C1, cathepsin F-like cysteine peptidase	0.0115	0.1653	0.1551
Echinococcus granulosus	cathepsin l1	0.0566	1	1
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.0566	1	1
Giardia lamblia	Hypothetical protein	0.0115	0.1653	0.4051
Entamoeba histolytica	cysteine protease, putative	0.0297	0.5037	0.4881
Echinococcus granulosus	FKBP12 rapamycin complex associated protein	0.0056	0.0567	0.003
Echinococcus multilocularis	FKBP12 rapamycin complex associated protein	0.0056	0.0567	0.003
Trypanosoma brucei	target of rapamycin kinase 3, putative	0.0045	0.037	0.037
Plasmodium vivax	dipeptidyl aminopeptidase 3, putative	0.0115	0.1653	0.1025
Trypanosoma brucei	peptidyl-prolyl cis-trans isomerase, putative	0.0063	0.0699	0.0699
Plasmodium vivax	vivapain-2	0.0566	1	1
Loa Loa (eye worm)	hypothetical protein	0.0115	0.1653	0.15
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0115	0.1653	0.1551
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0115	0.1653	0.15
Plasmodium vivax	serine-repeat antigen 3 (SERA)	0.0115	0.1653	0.1025
Echinococcus multilocularis	cathepsin L	0.0297	0.5037	0.4754
Loa Loa (eye worm)	hypothetical protein	0.0077	0.0967	0.0802
Trypanosoma cruzi	cysteine peptidase, putative	0.0183	0.2918	0.2789
Trypanosoma cruzi	cysteine proteinase, putative	0.0297	0.5037	0.4946
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0115	0.1653	0.1391
Schistosoma mansoni	ataxia telangiectasia mutated (atm)-related	0.0056	0.0567	0.0271
Echinococcus granulosus	cathepsin l1	0.0383	0.6616	0.6423
Onchocerca volvulus		0.0566	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0115	0.1653	0.1551
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0115	0.1653	0.1391
Loa Loa (eye worm)	hypothetical protein	0.0183	0.2918	0.2789
Loa Loa (eye worm)	FKBP-type peptidyl-prolyl cis-trans isomerase-12	0.0063	0.0699	0.053
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit gamma, putative	0.0118	0.1712	0.1611
Leishmania major	cathepsin L-like protease	0.0566	1	1
Leishmania major	cathepsin L-like protease	0.0566	1	1
Entamoeba histolytica	peptidyl-prolyl cis-trans isomerase, FKBP-type , putative	0.0063	0.0699	0.0407
Giardia lamblia	Cathepsin L precursor	0.0115	0.1653	0.4051
Trichomonas vaginalis	peptidylprolyl isomerase, putative	0.0063	0.0699	0.0586
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0115	0.1653	0.1391
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0115	0.1653	0.1391
Trypanosoma cruzi	major cysteine proteinase, putative	0.0115	0.1653	0.15
Loa Loa (eye worm)	phosphatidylinositol 3	0.0195	0.3143	0.3017
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0566	1	1
Brugia malayi	cathepsin L-like cysteine proteinase	0.0115	0.1653	0.1391
Loa Loa (eye worm)	hypothetical protein	0.0383	0.6616	0.6554
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0566	1	1
Schistosoma mansoni	subfamily C1A unassigned peptidase (C01 family)	0.0115	0.1653	0.1391
Loa Loa (eye worm)	cysteine protease	0.0566	1	1
Plasmodium vivax	unspecified product	0.0115	0.1653	0.1025
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0045	0.0369	0.0252
Entamoeba histolytica	cysteine protease, putative	0.0115	0.1653	0.1391
Brugia malayi	cathepsin Z-like cysteine proteinase	0.0115	0.1653	0.1391
Trypanosoma cruzi	cruzipain precursor, putative	0.0183	0.2918	0.2789
Echinococcus granulosus	phosphatidylinositol 45 bisphosphate 3 kinase	0.0218	0.3574	0.3208
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0115	0.1653	0.1551
Echinococcus granulosus	cathepsin L	0.0297	0.5037	0.4754
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0054	0.0535	0.0238
Schistosoma mansoni	cathepsin B (C01 family)	0.0115	0.1653	0.1391
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0383	0.6616	0.6575
Trypanosoma brucei	phosphatidylinositol 3-kinase, putative	0.0042	0.0304	0.0304
Giardia lamblia	Cathepsin B precursor	0.0115	0.1653	0.4051
Loa Loa (eye worm)	cathepsin B	0.0238	0.3945	0.3835
Schistosoma mansoni	cathepsin F (C01 family)	0.0566	1	1
Schistosoma mansoni	SmCB2 peptidase (C01 family)	0.0515	0.9065	0.9036
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0042	0.0319	0.0201
Plasmodium falciparum	cysteine proteinase falcipain 1	0.0297	0.5037	0.4664
Onchocerca volvulus	Cathepsin F homolog	0.0566	1	1
Onchocerca volvulus	Cathepsin L homolog	0.0566	1	1
Entamoeba histolytica	phosphatidylinositol 3-kinase 1, putative	0.0111	0.1587	0.1322
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.0515	0.9065	0.9048
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0515	0.9065	0.9036
Entamoeba histolytica	cysteine proteinase, putative	0.0566	1	1
Schistosoma mansoni	cathepsin C	0.0115	0.1653	0.1391
Brugia malayi	Cathepsin L-like cysteine proteinase	0.0383	0.6616	0.651
Trypanosoma cruzi	cysteine protease, putative	0.0297	0.5037	0.4946
Schistosoma mansoni	subfamily C1A unassigned peptidase (C01 family)	0.0115	0.1653	0.1391
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.0383	0.6616	0.6554
Trypanosoma brucei	phosphatidylinositol 4-kinase, putative	0.0056	0.0567	0.0567
Leishmania major	cathepsin L-like protease	0.0566	1	1
Loa Loa (eye worm)	hypothetical protein	0.0183	0.2918	0.2789
Leishmania major	peptidylprolyl isomerase-like protein	0.0063	0.0699	0.0342
Echinococcus granulosus	cysteine protease	0.0297	0.5037	0.4754
Onchocerca volvulus		0.0566	1	1
Giardia lamblia	Cathepsin B precursor	0.0238	0.3945	1
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.0566	1	1
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0094	0.128	0.1006
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0115	0.1653	0.1551
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0042	0.0319	0.0201
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0115	0.1653	0.1391
Giardia lamblia	FKBP-type peptidyl-prolyl cis-trans isomerase	0.0063	0.0699	0.1577
Entamoeba histolytica	cysteine proteinase, putative	0.0297	0.5037	0.4881
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0566	1	1
Onchocerca volvulus		0.0566	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0383	0.6616	0.6575
Toxoplasma gondii	cathepsin B	0.0238	0.3945	0.3746
Giardia lamblia	Cathepsin L-like protease	0.0115	0.1653	0.4051
Entamoeba histolytica	papain family cysteine protease domain containing protein	0.0115	0.1653	0.1391
Entamoeba histolytica	cysteine protease, putative	0.0297	0.5037	0.4881
Brugia malayi	cathepsin F-like cysteine proteinase	0.0183	0.2918	0.2696
Loa Loa (eye worm)	ctsf protein	0.0566	1	1
Plasmodium falciparum	cysteine proteinase falcipain 3	0.0566	1	1
Loa Loa (eye worm)	hypothetical protein	0.0383	0.6616	0.6554
Plasmodium falciparum	serine repeat antigen 6	0.0115	0.1653	0.1025
Trypanosoma cruzi	peptidyl-prolyl cis-trans isomerase, putative	0.0063	0.0699	0.053
Plasmodium vivax	serine-repeat antigen 4 (SERA), putative	0.0115	0.1653	0.1025
Onchocerca volvulus		0.0566	1	1
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.0566	1	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0566	1	1
Entamoeba histolytica	cysteine protease, putative	0.0115	0.1653	0.1391
Brugia malayi	Papain family cysteine protease containing protein	0.0115	0.1653	0.1391
Brugia malayi	Cathepsin L-like precursor	0.0183	0.2918	0.2696
Plasmodium vivax	serine-repeat antigen 5 (SERA)	0.0115	0.1653	0.1025
Plasmodium vivax	serine-repeat antigen 4 (SERA)	0.0115	0.1653	0.1025
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0118	0.1712	0.1611
Brugia malayi	phosphoinositide 3'-hydroxykinase p110-alpha subunit, putative	0.0101	0.1397	0.1127
Giardia lamblia	Cathepsin B precursor	0.0115	0.1653	0.4051
Trypanosoma brucei	cysteine peptidase C (CPC)	0.0238	0.3945	0.3945
Trypanosoma cruzi	major cysteine proteinase, putative	0.0115	0.1653	0.15
Brugia malayi	Cathepsin L-like precursor	0.0566	1	1
Giardia lamblia	70 kDa peptidylprolyl isomerase, putative	0.0063	0.0699	0.1577
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0566	1	1
Trypanosoma cruzi	cysteine peptidase, putative	0.0566	1	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0032	0.0121	0.0001
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0183	0.2918	0.2789
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0566	1	1
Schistosoma mansoni	cathepsin F (C01 family)	0.0383	0.6616	0.651
Echinococcus granulosus	cathepsin L	0.0115	0.1653	0.1177
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0115	0.1653	0.1551
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0515	0.9065	0.9036
Echinococcus multilocularis	cathepsin L	0.0115	0.1653	0.1177
Giardia lamblia	Cathepsin L precursor	0.0115	0.1653	0.4051
Toxoplasma gondii	preprocathepsin c precursor, putative	0.0115	0.1653	0.1378
Giardia lamblia	Cathepsin B precursor	0.0115	0.1653	0.4051
Echinococcus multilocularis	cysteine protease	0.0566	1	1
Trypanosoma cruzi	FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative	0.0063	0.0699	0.053
Loa Loa (eye worm)	phosphatidylinositol 3	0.0056	0.0567	0.0395
Plasmodium vivax	unspecified product	0.0297	0.5037	0.4664
Leishmania major	cathepsin L-like protease	0.0566	1	1
Plasmodium vivax	serine-repeat antigen 2 (SERA)	0.0115	0.1653	0.1025
Trichomonas vaginalis	Clan CA, family C1, cathepsin H-like cysteine peptidase	0.0115	0.1653	0.1551
Leishmania major	fk506-binding protein 1-like protein	0.0063	0.0699	0.0342
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0566	1	1
Plasmodium vivax	serine-repeat antigen (SERA), putative	0.0115	0.1653	0.1025
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	0.0042	0.0304	0.0186
Echinococcus multilocularis	phosphatidylinositol 4,5 bisphosphate 3 kinase	0.0218	0.3574	0.3208
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0045	0.0369	0.0252
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0566	1	1
Trichomonas vaginalis	immunophilin, putative	0.0063	0.0699	0.0586
Trichomonas vaginalis	conserved hypothetical protein	0.0115	0.1653	0.1551
Entamoeba histolytica	cysteine proteinase, putative	0.0297	0.5037	0.4881
Trypanosoma brucei	Phosphatidylinositol 3-kinase tor1	0.0056	0.0567	0.0567
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0042	0.0304	0.0186
Giardia lamblia	Cysteine protease	0.0115	0.1653	0.4051
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0115	0.1653	0.15
Entamoeba histolytica	cysteine protease, putative	0.0297	0.5037	0.4881
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0056	0.0567	0.0453
Entamoeba histolytica	cysteine protease, putative	0.0115	0.1653	0.1391
Echinococcus granulosus	peptidyl prolyl cis trans isomerase FKBP1A	0.0063	0.0699	0.0169
Echinococcus multilocularis	cathepsin L cysteine protease	0.0566	1	1
Loa Loa (eye worm)	hypothetical protein	0.0515	0.9065	0.9048
Plasmodium falciparum	serine repeat antigen 3	0.0115	0.1653	0.1025
Echinococcus granulosus	peptidyl prolyl cis trans isomerase FKBP4	0.0063	0.0699	0.0169
Leishmania major	cathepsin L-like protease	0.0566	1	1
Giardia lamblia	Dipeptidyl-peptidase I precursor	0.0115	0.1653	0.4051
Entamoeba histolytica	cysteine protease, putative	0.0115	0.1653	0.1391
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0297	0.5037	0.4976
Echinococcus multilocularis	fk506 binding protein	0.0063	0.0699	0.0169
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0042	0.0319	0.0201
Giardia lamblia	Cathepsin B precursor	0.0115	0.1653	0.4051
Echinococcus multilocularis	peptidyl prolyl cis trans isomerase FKBP4	0.0063	0.0699	0.0169
Brugia malayi	Papain family cysteine protease containing protein	0.0297	0.5037	0.4881
Treponema pallidum	peptidyl-prolyl cis-trans isomerase, FKBP-type, 22 kDa (fklB)	0.0063	0.0699	0.5
Loa Loa (eye worm)	hypothetical protein	0.0115	0.1653	0.15
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0297	0.5037	0.4881
Entamoeba histolytica	cysteine proteinase 2	0.0297	0.5037	0.4881
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0566	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0297	0.5037	0.4976
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0118	0.1712	0.1452
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0566	1	1
Loa Loa (eye worm)	hypothetical protein	0.0115	0.1653	0.15
Entamoeba histolytica	cysteine proteinase 1, putative	0.0297	0.5037	0.4881
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0566	1	1
Schistosoma mansoni	cathepsin S (C01 family)	0.0115	0.1653	0.1391
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0118	0.1712	0.1452
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0566	1	1
Trypanosoma cruzi	cysteine peptidase, putative	0.0297	0.5037	0.4946
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0056	0.0567	0.0271
Giardia lamblia	Phosphoinositide-3-kinase, catalytic, alpha polypeptide	0.0059	0.0618	0.1365
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0042	0.0319	0.0201
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0238	0.3945	0.3755
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0297	0.5037	0.4881
Brugia malayi	Cathepsin L-like precursor	0.0566	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0566	1	1
Schistosoma mansoni	dipeptidyl-peptidase I (C01 family)	0.0115	0.1653	0.1391
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0035	0.0177	0.0057
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0042	0.0319	0.0201
Leishmania major	target of rapamycin (TOR) kinase 1, putative	0.0056	0.0567	0.0205
Loa Loa (eye worm)	hypothetical protein	0.0054	0.0539	0.0366
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0566	1	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0566	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0115	0.1653	0.1551
Entamoeba histolytica	cysteine protease, putative	0.0297	0.5037	0.4881
Giardia lamblia	Encystation-specific protease	0.0115	0.1653	0.4051
Schistosoma mansoni	cathepsin s	0.0183	0.2918	0.2696
Leishmania major	cathepsin L-like protease	0.0566	1	1
Loa Loa (eye worm)	hypothetical protein	0.0115	0.1653	0.15
Trypanosoma brucei	FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative	0.0063	0.0699	0.0699
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0115	0.1653	0.1551
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0218	0.3574	0.3373
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0037	0.0227	0.0108
Loa Loa (eye worm)	hypothetical protein	0.0566	1	1
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.0118	0.1712	0.1561
Plasmodium falciparum	dipeptidyl aminopeptidase 1	0.0115	0.1653	0.1025
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0115	0.1653	0.1551
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0045	0.0369	0.0252
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0566	1	1
Plasmodium falciparum	serine repeat antigen 8	0.0115	0.1653	0.1025
Entamoeba histolytica	cysteine protease, putative	0.0297	0.5037	0.4881
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	0.0082	0.1049	0.0941
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0566	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0115	0.1653	0.1551
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0042	0.0319	0.0201
Giardia lamblia	Cathepsin B precursor	0.0238	0.3945	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0035	0.0177	0.0057
Brugia malayi	Cathepsin L-like precursor	0.0566	1	1
Echinococcus multilocularis	cathepsin b	0.0515	0.9065	0.9012
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0566	1	1
Entamoeba histolytica	cysteine protease, putative	0.0297	0.5037	0.4881
Trichomonas vaginalis	fk506-binding protein, putative	0.0063	0.0699	0.0586
Onchocerca volvulus		0.0566	1	1
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0115	0.1653	0.1551
Echinococcus multilocularis	cathepsin L cysteine protease	0.0566	1	1
Trichomonas vaginalis	phopsphatidylinositol 3-kinase, drosophila, putative	0.0118	0.1712	0.1611
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0566	1	1
Brugia malayi	Cathepsin L-like precursor	0.0566	1	1
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor2	0.0056	0.0567	0.0395
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0238	0.3945	0.3871
Schistosoma mansoni	immunophilin	0.0063	0.0699	0.0407
Entamoeba histolytica	papain family cysteine protease domain containing protein	0.0115	0.1653	0.1391
Schistosoma mansoni	immunophilin	0.0054	0.0539	0.0242
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0034	0.0171	0.0052
Brugia malayi	cathepsin L-like precursor	0.0383	0.6616	0.651
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0077	0.0967	0.0683
Brugia malayi	FKBP-type peptidyl-prolyl cis-trans isomerase-59, BmFKBP59	0.0063	0.0699	0.0407
Entamoeba histolytica	cysteine proteinase, putative	0.0566	1	1
Onchocerca volvulus		0.0566	1	1
Schistosoma mansoni	immunophilin FK506 binding protein FKBP12	0.0063	0.0699	0.0407
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0297	0.5037	0.5037
Giardia lamblia	Dipeptidyl-peptidase I precursor	0.0115	0.1653	0.4051
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0115	0.1653	0.1551
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0566	1	1
Echinococcus granulosus	cathepsin L cysteine protease	0.0297	0.5037	0.4754
Plasmodium vivax	vivapain-2	0.0566	1	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0032	0.0121	0.0001
Loa Loa (eye worm)	fibroinase	0.0566	1	1
Trypanosoma cruzi	FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative	0.0063	0.0699	0.053

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 1 nM	Inhibition of human full-length MKNK1 using biotin-Ahx-IKKRKLTRRKSLKG substrate by TR-FRET-based high ATP assay	ChEMBL.	25589917

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: CHEMBL3355000

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 944703