TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 225.246 | Formula: C13H11N3O
H donors: 0 H acceptors: 2 LogP: 1.26 Rotable bonds: 3
Rule of 5 violations (Lipinski): 1
SMILES: c1occ(c1)c1ccc(cn1)Cn1cncc1
InChi: 1S/C13H11N3O/c1-2-13(12-3-6-17-9-12)15-7-11(1)8-16-5-4-14-10-16/h1-7,9-10H,8H2
InChiKey: BDOFEVRLGSFGCU-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	cytochrome P450, family 11, subfamily B, polypeptide 2	Starlite/ChEMBL	References
Homo sapiens	cytochrome P450, family 11, subfamily B, polypeptide 1	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Toxoplasma gondii	cytochrome p450 superfamily protein	Get druggable targets OG5_134469	All targets in OG5_134469
Neospora caninum	Os02g0824100 protein, related	Get druggable targets OG5_134469	All targets in OG5_134469

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
Giardia lamblia	Phosphatidylinositol 4-kinase	0.0134	0.058	0.058
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.0021	0.0032	0.0032
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0134	0.058	0.058
Loa Loa (eye worm)	hypothetical protein	0.0259	0.1185	0.1185
Trypanosoma cruzi	phosphatidylinositol 4-kinase, putative	0.0134	0.058	0.058
Trichomonas vaginalis	conserved hypothetical protein	0.0438	0.2052	0.2052
Brugia malayi	Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog	0.0073	0.0283	0.0283
Schistosoma mansoni	serine/threonine-protein kinase	0.0023	0.0041	0.0041
Treponema pallidum	peptidyl-prolyl cis-trans isomerase, FKBP-type, 22 kDa (fklB)	0.0105	0.044	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1228	0.5888	0.5888
Echinococcus multilocularis	voltage gated potassium channel	0.0021	0.0032	0.0032
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0696	0.3307	0.3307
Echinococcus multilocularis	nervana 2	0.002	0.003	0.003
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0134	0.058	1
Brugia malayi	Voltage-gated potassium channel, EAG (KCNH1)-related. C. elegans egl-2 ortholog	0.0021	0.0032	0.0032
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0393	0.1835	0.1835
Giardia lamblia	Kinase, AGC PKA	0.0021	0.0031	0.003
Loa Loa (eye worm)	phosphatidylinositol kinase	0.0134	0.058	0.058
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0134	0.058	0.058
Schistosoma mansoni	phosphatidylinositol 4-kinase	0.0134	0.058	0.058
Echinococcus multilocularis	phosphatidylinositol 4 kinase alpha	0.0134	0.058	0.058
Trypanosoma brucei	phosphatidylinositol 3-kinase catalytic subunit, putative	0.0134	0.058	0.058
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0134	0.058	0.058
Echinococcus granulosus	peptidyl prolyl cis trans isomerase FKBP1A	0.0105	0.044	0.044
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1773	0.8528	0.8528
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0134	0.058	0.058
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0696	0.3307	0.3307
Entamoeba histolytica	FKBP-rapamycin associated protein (FRAP), putative	0.2076	1	1
Plasmodium falciparum	phosphatidylinositol 3-kinase	0.0134	0.058	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0134	0.058	0.058
Echinococcus multilocularis	serine protein kinase ATM	0.0393	0.1835	0.1835
Leishmania major	hypothetical protein, unknown function	0.0134	0.058	0.058
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1651	0.794	0.794
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1544	0.742	0.742
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1121	0.5368	0.5368
Giardia lamblia	Phosphoinositide-3-kinase, catalytic, alpha polypeptide	0.0134	0.058	0.058
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.0393	0.1835	0.1835
Trypanosoma brucei	phosphatidylinositol 4-kinase, putative	0.2076	1	1
Leishmania major	peptidylprolyl isomerase-like protein	0.0105	0.044	0.0439
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1544	0.742	0.742
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0134	0.058	0.058
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit gamma, putative	0.0134	0.058	0.058
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1121	0.5368	0.5368
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0393	0.1835	0.1835
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0134	0.058	0.0781
Trichomonas vaginalis	peptidylprolyl isomerase, putative	0.0105	0.044	0.044
Trichomonas vaginalis	AGC family protein kinase	0.0033	0.0091	0.0091
Trypanosoma cruzi	phosphatidylinositol 4-kinase, putative	0.0134	0.058	0.058
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.0073	0.0283	0.0283
Onchocerca volvulus		0.0134	0.058	1
Plasmodium vivax	phosphatidylinositol 3- and 4-kinase, putative	0.0134	0.058	1
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.0134	0.058	0.058
Echinococcus granulosus	nervana 2	0.002	0.003	0.003
Schistosoma mansoni	hypothetical protein	0.0304	0.1403	0.1403
Trichomonas vaginalis	phopsphatidylinositol 3-kinase, drosophila, putative	0.0134	0.058	0.058
Loa Loa (eye worm)	hypothetical protein	0.0304	0.1403	0.1403
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1241	0.5947	0.5947
Entamoeba histolytica	peptidyl-prolyl cis-trans isomerase, FKBP-type , putative	0.0105	0.044	0.0439
Giardia lamblia	Hypothetical protein	0.0134	0.058	0.058
Giardia lamblia	Phosphoinositide-3-kinase, class 3	0.0134	0.058	0.058
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0134	0.058	0.058
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1119	0.5359	0.5359
Schistosoma mansoni	immunophilin	0.0105	0.044	0.044
Loa Loa (eye worm)	phosphatidylinositol 3	0.0134	0.058	0.058
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1228	0.5888	0.5888
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	0.0134	0.058	0.058
Schistosoma mansoni	ataxia telangiectasia mutated (atm)	0.0393	0.1835	0.1835
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0068	0.026	0.026
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0696	0.3307	0.3307
Loa Loa (eye worm)	phosphatidylinositol 3	0.0696	0.3307	0.3307
Plasmodium falciparum	peptidyl-prolyl cis-trans isomerase FKBP35	0.0105	0.044	0.7577
Loa Loa (eye worm)	hypothetical protein	0.0438	0.2052	0.2052
Brugia malayi	p70 ribosomal S6 kinase beta	0.0031	0.0081	0.0081
Echinococcus granulosus	phosphatidylinositol 4 kinase alpha	0.0134	0.058	0.058
Mycobacterium ulcerans	FK-506 binding protein, peptidyl-prolyl cis-trans isomerase	0.0105	0.044	1
Entamoeba histolytica	hypothetical protein	0.0134	0.058	0.058
Toxoplasma gondii	AGC kinase	0.0031	0.0081	0.0109
Leishmania major	fk506-binding protein 1-like protein	0.0105	0.044	0.0439
Loa Loa (eye worm)	voltage and ligand gated potassium channel	0.0073	0.0283	0.0283
Echinococcus multilocularis	nervana 2	0.002	0.003	0.003
Echinococcus granulosus	PIK kinase FAT and Armadillo domain containing protein	0.0304	0.1403	0.1403
Schistosoma mansoni	hypothetical protein	0.0134	0.058	0.058
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.0021	0.0032	0.0032
Trypanosoma brucei	phosphatidylinositol kinase related protein, putative	0.0393	0.1835	0.1835
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0696	0.3307	0.3307
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0134	0.058	0.0781
Trypanosoma cruzi	phosphatidylinositol 3-kinase, putative	0.0393	0.1835	0.1835
Trypanosoma brucei	FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative	0.0105	0.044	0.0439
Leishmania major	target of rapamycin (TOR) kinase 1, putative	0.2076	1	1
Trypanosoma brucei	phosphatidylinositol 4-kinase, putative	0.0134	0.058	0.058
Trypanosoma brucei	FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative	0.0862	0.4113	0.4113
Toxoplasma gondii	FATC domain-containing protein	0.0393	0.1835	0.2473
Onchocerca volvulus		0.0134	0.058	1
Loa Loa (eye worm)	hypothetical protein	0.0134	0.058	0.058
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2076	1	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1119	0.5359	0.5359
Echinococcus granulosus	phosphatidylinositol 4 phosphate 3 kinase C2	0.0134	0.058	0.058
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1241	0.5947	0.5947
Trypanosoma cruzi	target of rapamycin kinase 3	0.1653	0.7948	0.7948
Echinococcus multilocularis	peptidyl prolyl cis trans isomerase FKBP4	0.0091	0.0369	0.0369
Trypanosoma cruzi	peptidyl-prolyl cis-trans isomerase, putative	0.0105	0.044	0.0439
Loa Loa (eye worm)	hypothetical protein	0.0393	0.1835	0.1835
Loa Loa (eye worm)	phosphatidylinositol 3	0.0134	0.058	0.058
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0259	0.1185	0.1185
Schistosoma mansoni	voltage-gated potassium channel	0.0021	0.0032	0.0032
Loa Loa (eye worm)	phosphatidylinositol 3	0.2076	1	1
Entamoeba histolytica	hypothetical protein	0.0134	0.058	0.058
Entamoeba histolytica	phosphatidylinositol 3-kinase 3, putative	0.0134	0.058	0.058
Trypanosoma cruzi	phosphatidylinositol 4-kinase alpha, putative	0.0134	0.058	0.058
Loa Loa (eye worm)	AGC/AKT protein kinase	0.0033	0.0091	0.0091
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0134	0.058	0.058
Echinococcus multilocularis	FKBP12 rapamycin complex associated protein	0.2076	1	1
Trypanosoma cruzi	FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative	0.0105	0.044	0.0439
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0393	0.1835	0.1835
Trichomonas vaginalis	AGC family protein kinase	0.0033	0.0091	0.0091
Trichomonas vaginalis	AGC family protein kinase	0.0033	0.0091	0.0091
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0134	0.058	0.058
Leishmania major	target of rapamycin kinase (TOR) kinase 3	0.1653	0.7948	0.7948
Trypanosoma cruzi	peptidyl-prolyl cis-trans isomerase, putative	0.0105	0.044	0.0439
Echinococcus granulosus	DNA dependent protein kinase catalytic subunit	0.0134	0.058	0.058
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1544	0.742	0.742
Schistosoma mansoni	immunophilin FK506 binding protein FKBP12	0.0105	0.044	0.044
Echinococcus multilocularis	Phosphatidylinositol 4 kinase type 2 beta	0.0134	0.058	0.058
Entamoeba histolytica	protein kinase 2, putative	0.0021	0.0031	0.003
Echinococcus multilocularis	DNA dependent protein kinase catalytic subunit	0.0134	0.058	0.058
Trichomonas vaginalis	fk506-binding protein, putative	0.0105	0.044	0.044
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0134	0.058	0.058
Entamoeba histolytica	peptidyl-prolyl cis-trans isomerase, FKBP-type, putative	0.0105	0.044	0.0439
Schistosoma mansoni	voltage-gated potassium channel	0.0021	0.0032	0.0032
Trypanosoma cruzi	rac serine-threonine kinase, putative	0.0021	0.0031	0.003
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.0259	0.1185	0.1185
Echinococcus granulosus	Phosphatidylinositol 4 kinase type 2 beta	0.0134	0.058	0.058
Plasmodium vivax	rac-beta serine/threonine protein kinase, putative	0.0021	0.0031	0.0525
Giardia lamblia	GTOR	0.2076	1	1
Entamoeba histolytica	phosphatidylinositol-4,5-bisphosphate 3-kinase, putative	0.0134	0.058	0.058
Schistosoma mansoni	fkbp-rapamycin associated protein	0.0393	0.1835	0.1835
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0134	0.058	0.058
Leishmania major	phosphatidylinositol 3-kinase, putative	0.0696	0.3307	0.3307
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0134	0.058	0.0781
Entamoeba histolytica	PH domain containing protein kinase, putative	0.0023	0.0041	0.004
Leishmania major	phosphatidylinositol 4-kinase alpha, putative	0.0134	0.058	0.058
Plasmodium falciparum	RAC-beta serine/threonine protein kinase	0.0021	0.0031	0.0525
Trypanosoma brucei	Phosphatidylinositol 3-kinase tor1	0.2076	1	1
Trypanosoma brucei	phosphatidylinositol 4-kinase alpha, putative	0.0134	0.058	0.058
Trichomonas vaginalis	AGC family protein kinase	0.0033	0.0091	0.0091
Leishmania major	phosphatidylinositol kinase related protein, putative	0.0134	0.058	0.058
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0696	0.3307	0.3307
Schistosoma mansoni	phosphatidylinositol 4-kinase	0.0134	0.058	0.058
Toxoplasma gondii	cytochrome p450 superfamily protein	0.0918	0.4381	0.5904
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0134	0.058	0.0781
Trichomonas vaginalis	immunophilin, putative	0.0105	0.044	0.044
Echinococcus granulosus	Glutaredoxin protein 5	0.002	0.003	0.003
Echinococcus granulosus	sodium:potassium dependent atpase beta subunit	0.002	0.003	0.003
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0134	0.058	0.058
Echinococcus granulosus	FKBP12 rapamycin complex associated protein	0.2076	1	1
Schistosoma mansoni	immunophilin	0.0091	0.0369	0.0369
Leishmania major	phosphatidylinositol 3-related kinase, putative	0.0696	0.3307	0.3307
Echinococcus granulosus	calcium:calmodulin dependent protein kinase	0.0021	0.0031	0.0031
Trichomonas vaginalis	conserved hypothetical protein	0.0259	0.1185	0.1185
Entamoeba histolytica	PH domain containing protein kinase, putative	0.0023	0.0041	0.004
Schistosoma mansoni	phosphatidylinositol 3-and 4-kinase	0.0696	0.3307	0.3307
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1348	0.6467	0.6467
Echinococcus granulosus	nervana 2	0.002	0.003	0.003
Echinococcus granulosus	peptidyl prolyl cis trans isomerase FKBP4	0.0091	0.0369	0.0369
Leishmania major	phosphatidylinositol 4-kinase, putative	0.0134	0.058	0.058
Echinococcus multilocularis	peptidyl prolyl cis trans isomerase FKBP4	0.0105	0.044	0.044
Plasmodium vivax	phosphatidylinositol 3-kinase, putative	0.0134	0.058	1
Echinococcus granulosus	phosphatidylinositol 45 bisphosphate 3 kinase	0.0134	0.058	0.058
Leishmania major	hypothetical protein, conserved	0.0134	0.058	0.058
Trichomonas vaginalis	AGC family protein kinase	0.0033	0.0091	0.0091
Entamoeba histolytica	phosphatidylinositol3-kinaseTor2, putative	0.2076	1	1
Trypanosoma cruzi	rac serine-threonine kinase, putative	0.0023	0.0041	0.004
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2076	1	1
Schistosoma mansoni	voltage-gated potassium channel	0.0079	0.0315	0.0315
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0696	0.3307	0.3307
Trypanosoma cruzi	phosphatidylinositol 4-kinase alpha, putative	0.0134	0.058	0.058
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0134	0.058	0.058
Brugia malayi	Protein kinase domain containing protein	0.0033	0.0091	0.0091
Schistosoma mansoni	voltage-gated potassium channel	0.0079	0.0315	0.0315
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1651	0.794	0.794
Trypanosoma brucei	phosphatidylinositol 3-kinase tor, putative	0.0982	0.4692	0.4692
Trypanosoma brucei	phosphatidylinositol 3-kinase, putative	0.0134	0.058	0.058
Trypanosoma cruzi	Protein kinase B	0.0023	0.0041	0.004
Mycobacterium leprae	conserved hypothetical protein	0.0134	0.058	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1121	0.5368	0.5368
Echinococcus multilocularis	serine threonine protein kinase nrc serine threonine protein kinase gad	0.0021	0.0031	0.0031
Echinococcus multilocularis	Phosphatidylinositol 4 kinase type 2 beta	0.0134	0.058	0.058
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0393	0.1835	0.1835
Loa Loa (eye worm)	AGC/RSK/P70 protein kinase	0.0031	0.0081	0.0081
Trypanosoma brucei	phosphatidylinositol 3-kinase, putative	0.0696	0.3307	0.3307
Leishmania major	target of rapamycin (TOR) kinase 2, putative	0.2076	1	1
Trypanosoma cruzi	phosphatidylinositol 3-kinase vps34-like	0.0134	0.058	0.058
Loa Loa (eye worm)	phosphatidylinositol 4-kinase type 3 alpha isoform 1	0.0134	0.058	0.058
Plasmodium falciparum	phosphatidylinositol 3- and 4-kinase, putative	0.0134	0.058	1
Echinococcus granulosus	serine:threonine protein kinase SMG1	0.0393	0.1835	0.1835
Plasmodium vivax	phosphatidylinositol 4-kinase, putative	0.0134	0.058	1
Schistosoma mansoni	phosphatidylinositol 3-kinase class	0.0134	0.058	0.058
Brugia malayi	FKBP-type peptidyl-prolyl cis-trans isomerase-12, BmFKBP-12	0.0105	0.044	0.044
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0134	0.058	0.058
Echinococcus multilocularis		0.0134	0.058	0.058
Echinococcus granulosus	phosphatidylinositol 4 kinase beta	0.0134	0.058	0.058
Entamoeba histolytica	protein kinase, putative	0.0033	0.0091	0.0091
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0134	0.058	0.058
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1651	0.794	0.794
Entamoeba histolytica	hypothetical protein	0.0393	0.1835	0.1835
Loa Loa (eye worm)	phosphatidylinositol 3	0.0134	0.058	0.058
Entamoeba histolytica	Phosphatidylinositol 3- and 4-kinase family	0.0393	0.1835	0.1835
Trypanosoma brucei	target of rapamycin kinase 3, putative	0.1653	0.7948	0.7948
Trichomonas vaginalis	AGC family protein kinase	0.0033	0.0091	0.0091
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0134	0.058	0.058
Chlamydia trachomatis	peptidyl-prolyl cis-trans isomerase	0.0014	0	0.5
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0134	0.058	0.058
Echinococcus multilocularis	fk506 binding protein	0.0105	0.044	0.044
Echinococcus multilocularis	rac serine:threonine kinase	0.0023	0.0041	0.0041
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0134	0.058	0.058
Schistosoma mansoni	ataxia telangiectasia mutated (atm)-related	0.2076	1	1
Echinococcus multilocularis	Zinc finger, PHD finger	0.0134	0.058	0.058
Trypanosoma cruzi	phosphatidylinositol 3-related kinase, putative	0.0696	0.3307	0.3307
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1241	0.5947	0.5947
Trichomonas vaginalis	peptidylprolyl isomerase, putative	0.0105	0.044	0.044
Echinococcus multilocularis	sodium:potassium dependent atpase beta subunit	0.002	0.003	0.003
Trichomonas vaginalis	PIKK family atypical protein kinase	0.2076	1	1
Trichomonas vaginalis	phosphatidylinositol 4-kinase, putative	0.0134	0.058	0.058
Schistosoma mansoni	immunophilin	0.0105	0.044	0.044
Entamoeba histolytica	protein kinase, putative	0.0031	0.0081	0.0081
Echinococcus multilocularis	Glutaredoxin protein 5	0.002	0.003	0.003
Entamoeba histolytica	phosphatidylinositol 4-kinase, putative	0.0134	0.058	0.058
Echinococcus granulosus	serine/threonine protein kinase	0.0023	0.0041	0.0041
Trypanosoma brucei	phosphatidylinositol 3-related kinase, putative	0.0696	0.3307	0.3307
Trypanosoma brucei	peptidyl-prolyl cis-trans isomerase, putative	0.0105	0.044	0.0439
Echinococcus granulosus	phosphatidylinositol 3 and 4 kinase	0.0696	0.3307	0.3307
Entamoeba histolytica	hypothetical protein	0.0134	0.058	0.058
Trypanosoma brucei	rac serine-threonine kinase, putative	0.0033	0.0091	0.0091
Leishmania major	phosphatidylinositol 3-kinase, putative	0.0134	0.058	0.058
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1651	0.794	0.794
Plasmodium vivax	phosphatidylinositol 4-kinase, putative	0.0134	0.058	1
Trypanosoma cruzi	phosphatidylinositol 3-related kinase, putative	0.0696	0.3307	0.3307
Loa Loa (eye worm)	phosphatidylinositol 3	0.0134	0.058	0.058
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1544	0.742	0.742
Echinococcus granulosus	voltage gated potassium channel	0.0021	0.0032	0.0032
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0134	0.058	0.058
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	0.0134	0.058	0.058
Leishmania major	phosphatidylinositol kinase, putative	0.0134	0.058	0.058
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1544	0.742	0.742
Loa Loa (eye worm)	phosphatidylinositol 3	0.0134	0.058	0.058
Loa Loa (eye worm)	hypothetical protein	0.0134	0.058	0.058
Entamoeba histolytica	protein kinase, putative	0.0033	0.0091	0.0091
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1544	0.742	0.742
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0557	0.2632	0.2632
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor1	0.2076	1	1
Giardia lamblia	70 kDa peptidylprolyl isomerase, putative	0.0105	0.044	0.0439
Giardia lamblia	FKBP-type peptidyl-prolyl cis-trans isomerase	0.0105	0.044	0.0439
Echinococcus granulosus	Phosphatidylinositol 4 kinase type 2 beta	0.0134	0.058	0.058
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.0134	0.058	0.058
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0068	0.026	0.026
Brugia malayi	phosphatidylinositol 4-kinase, catalytic, alpha polypeptide	0.0134	0.058	0.058
Trichomonas vaginalis	AGC family protein kinase	0.0033	0.0091	0.0091
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.0134	0.058	0.058
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor2	0.2076	1	1
Brugia malayi	FKBP-type peptidyl-prolyl cis-trans isomerase-59, BmFKBP59	0.0105	0.044	0.044
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0393	0.1835	0.1835
Plasmodium vivax	hypothetical protein	0.0134	0.058	1
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0134	0.058	0.058
Trypanosoma cruzi	phosphatidylinositol kinase, putative	0.0134	0.058	0.058
Echinococcus multilocularis	PIK kinase, FAT and Armadillo domain containing protein	0.0304	0.1403	0.1403
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0134	0.058	0.058
Echinococcus granulosus	serine threonine protein kinase nrc	0.0021	0.0031	0.0031
Toxoplasma gondii	non-specific serine/threonine protein kinase	0.0438	0.2052	0.2766
Loa Loa (eye worm)	FKBP5 protein	0.0105	0.044	0.044
Toxoplasma gondii	target of rapamycin (TOR), putative	0.1544	0.742	1
Echinococcus granulosus	phosphatidylinositol 3 kinase catalytic subunit	0.0134	0.058	0.058
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1393	0.6685	0.6685
Brugia malayi	FAT domain containing protein	0.0304	0.1403	0.1403
Entamoeba histolytica	hypothetical protein	0.0134	0.058	0.058
Plasmodium falciparum	phosphatidylinositol 4-kinase	0.0134	0.058	1
Trypanosoma cruzi	phosphatidylinositol 3-kinase, putative	0.0134	0.058	0.058
Entamoeba histolytica	protein kinase rad3, putative	0.0393	0.1835	0.1835
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1544	0.742	0.742
Loa Loa (eye worm)	hypothetical protein	0.0091	0.0369	0.0369
Echinococcus multilocularis	phosphatidylinositol 4 phosphate 3 kinase C2	0.0134	0.058	0.058
Trypanosoma cruzi	FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative	0.0105	0.044	0.0439
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0134	0.058	0.058
Echinococcus multilocularis	serine:threonine protein kinase SMG1	0.0393	0.1835	0.1835
Wolbachia endosymbiont of Brugia malayi	FKBP-type peptidylprolyl isomerase	0.0014	0	0.5
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1651	0.794	0.794
Trichomonas vaginalis	phopsphatidylinositol 3-kinase, drosophila, putative	0.0134	0.058	0.058
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1121	0.5368	0.5368
Loa Loa (eye worm)	FKBP-type peptidyl-prolyl cis-trans isomerase-12	0.0105	0.044	0.044
Echinococcus multilocularis	phosphatidylinositol 4,5 bisphosphate 3 kinase	0.0134	0.058	0.058
Schistosoma mansoni	phosphatidylinositol 4-kinase type-II	0.0134	0.058	0.058
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1119	0.5359	0.5359
Echinococcus multilocularis	phosphatidylinositol 3 and 4 kinase	0.0696	0.3307	0.3307
Echinococcus granulosus	serine protein kinase ATM	0.0393	0.1835	0.1835
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0236	0.0236
Wolbachia endosymbiont of Brugia malayi	FKBP-type peptidylprolyl isomerase	0.0014	0	0.5
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0134	0.058	0.0781
Trichomonas vaginalis	conserved hypothetical protein	0.0304	0.1403	0.1403
Loa Loa (eye worm)	hypothetical protein	0.0423	0.1982	0.1982
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0134	0.058	0.058
Echinococcus granulosus	peptidyl prolyl cis trans isomerase FKBP4	0.0105	0.044	0.044
Plasmodium vivax	70 kDa peptidylprolyl isomerase, putative	0.0105	0.044	0.7577
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0032	0.0032
Schistosoma mansoni	serine/threonine-protein kinase	0.0023	0.0041	0.0041
Plasmodium vivax	hypothetical protein, conserved	0.0134	0.058	1
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.0073	0.0283	0.0283

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 76 nM	Inhibition of human CYP11B1 expressed in hamster V79 MZ cells using [3H] 11 deoxycorticosterone as substrate by HPLC radioflow detector	ChEMBL.	24900349
IC50 (binding)	= 76 nM	Cellular Inhibition Assay	BINDINGDB.	No reference
IC50 (binding)	= 2832 nM	Inhibition of human CYP11B2 expressed in hamster V79 MZ cells using [3H] 11 deoxycorticosterone as substrate by HPLC radioflow detector	ChEMBL.	24900349
IC50 (binding)	= 2832 nM	Cellular Inhibition Assay	BINDINGDB.	No reference
Inhibition (binding)	< 10 %	Inhibition of human recombinant CYP17 expressed in Escherichia coli using progesterone as substrate at 2 uM	ChEMBL.	24900349
Inhibition (binding)	< 10 %	Inhibition of human recombinant CYP19 expressed in Escherichia coli using [1beta-3H]androstenedione as substrate at 0.5 uM	ChEMBL.	24900349

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: CHEMBL2011435

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1635397