TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 566.536 | Formula: C24H31FN6O9
H donors: 7 H acceptors: 9 LogP: -4.34 Rotable bonds: 19
Rule of 5 violations (Lipinski): 3
SMILES: NCC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)NCC(=O)NCC(=O)O)CC(=O)O)Cc1ccc(cc1)F
InChi: 1S/C24H31FN6O9/c25-14-5-3-13(4-6-14)8-16(29-18(32)10-26)24(40)31-7-1-2-17(31)23(39)30-15(9-20(34)35)22(38)28-11-19(33)27-12-21(36)37/h3-6,15-17H,1-2,7-12,26H2,(H,27,33)(H,28,38)(H,29,32)(H,30,39)(H,34,35)(H,36,37)/t15-,16-,17-/m0/s1
InChiKey: GXQFOENHBAJXQH-ULQDDVLXSA-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	3-hydroxy-3-methylglutaryl-CoA reductase	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Trypanosoma cruzi	3-hydroxy-3-methylglutaryl-CoA reductase, putative	Get druggable targets OG5_127955	All targets in OG5_127955
Candida albicans	hydroxymethylglutaryl-CoA reductase (ergosterol biosynthesis)	Get druggable targets OG5_127955	All targets in OG5_127955
Leishmania major	3-hydroxy-3-methylglutaryl-CoA reductase	Get druggable targets OG5_127955	All targets in OG5_127955
Brugia malayi	Hydroxymethylglutaryl-coenzyme A reductase family protein	Get druggable targets OG5_127955	All targets in OG5_127955
Trypanosoma congolense	3-hydroxy-3-methylglutaryl-CoA reductase, putative	Get druggable targets OG5_127955	All targets in OG5_127955
Trypanosoma brucei	3-hydroxy-3-methylglutaryl-CoA reductase, putative	Get druggable targets OG5_127955	All targets in OG5_127955
Schistosoma japonicum	ko:K00021 3-hydroxy-3-methylglutaryl-CoA reductase [EC1.1.1.34], putative	Get druggable targets OG5_127955	All targets in OG5_127955
Trypanosoma brucei gambiense	3-hydroxy-3-methylglutaryl-CoA reductase, putative	Get druggable targets OG5_127955	All targets in OG5_127955
Leishmania infantum	3-hydroxy-3-methylglutaryl-CoA reductase, putative	Get druggable targets OG5_127955	All targets in OG5_127955
Echinococcus granulosus	hydroxymethylglutaryl coenzyme A reductase	Get druggable targets OG5_127955	All targets in OG5_127955
Leishmania braziliensis	3-hydroxy-3-methylglutaryl-CoA reductase, putative	Get druggable targets OG5_127955	All targets in OG5_127955
Leishmania mexicana	3-hydroxy-3-methylglutaryl-CoA reductase, putative	Get druggable targets OG5_127955	All targets in OG5_127955
Candida albicans	hydroxymethylglutaryl-CoA reductase (ergosterol biosynthesis)	Get druggable targets OG5_127955	All targets in OG5_127955
Schistosoma mansoni	hydroxymethylglutaryl-CoA reductase (NADPH)	Get druggable targets OG5_127955	All targets in OG5_127955
Leishmania donovani	3-hydroxy-3-methylglutaryl-CoA reductase, putative	Get druggable targets OG5_127955	All targets in OG5_127955
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_127955	All targets in OG5_127955
Mycobacterium ulcerans	hydroxymethylglutaryl-coenzyme a (HMG-CoA) reductase	Get druggable targets OG5_127955	All targets in OG5_127955
Trypanosoma cruzi	3-hydroxy-3-methylglutaryl-CoA reductase	Get druggable targets OG5_127955	All targets in OG5_127955
Echinococcus multilocularis	hydroxymethylglutaryl coenzyme A reductase	Get druggable targets OG5_127955	All targets in OG5_127955

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
Brugia malayi	latrophilin 2 splice variant baaae	0.0103	0.1519	0.5987
Echinococcus granulosus	Niemann Pick C1 protein	0.0212	0.3311	0.3311
Trichomonas vaginalis	ap endonuclease, putative	0.0019	0.0138	0.079
Echinococcus multilocularis	geminin	0.0171	0.2623	0.2623
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0048	0.0611	0.0611
Echinococcus granulosus	importin 5	0.0011	0.0008	0.0008
Trypanosoma brucei	importin beta-1 subunit, putative	0.0058	0.0781	0.3055
Plasmodium falciparum	importin beta, putative	0.0058	0.0781	1
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0048	0.0611	0.0611
Loa Loa (eye worm)	importin-beta domain-containing protein	0.0011	0.0008	0.0008
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0092	0.1331	0.1331
Schistosoma mansoni	hypothetical protein	0.0103	0.1519	0.1519
Echinococcus multilocularis	GPCR, family 2	0.0048	0.0611	0.0611
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0092	0.1331	0.1331
Loa Loa (eye worm)	hypothetical protein	0.0103	0.1519	0.1519
Echinococcus multilocularis	translational activator gcn1	0.0011	0.0008	0.0008
Brugia malayi	jmjC domain containing protein	0.0025	0.0241	0.0949
Brugia malayi	jmjC domain containing protein	0.0025	0.0241	0.0949
Schistosoma mansoni	ubiquitin-specific peptidase 2 (C19 family)	0.0037	0.0428	0.0428
Echinococcus granulosus	geminin	0.0171	0.2623	0.2623
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0048	0.0611	0.2407
Loa Loa (eye worm)	MH2 domain-containing protein	0.0121	0.1812	0.1812
Schistosoma mansoni	hypothetical protein	0.0042	0.0513	0.0513
Loa Loa (eye worm)	PHD-finger family protein	0.003	0.0318	0.0318
Echinococcus multilocularis	peregrin	0.003	0.0318	0.0318
Trypanosoma cruzi	JmjC domain, hydroxylase, putative	0.0025	0.0241	0.0428
Entamoeba histolytica	Niemann-Pick C1 protein, putative	0.0101	0.1485	1
Echinococcus granulosus	peregrin	0.003	0.0318	0.0318
Plasmodium vivax	GTP-binding nuclear protein RAN/TC4, putative	0.0043	0.0529	0.6744
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0092	0.1331	0.1331
Schistosoma mansoni	cpg binding protein	0.0028	0.0283	0.0283
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0048	0.0611	0.0611
Toxoplasma gondii	GTP-binding nuclear protein ran/tc4	0.0043	0.0529	0.6744
Loa Loa (eye worm)	jmjC domain-containing protein	0.0025	0.0241	0.0241
Trichomonas vaginalis	importin beta-1, putative	0.0047	0.0601	0.3599
Toxoplasma gondii	exonuclease III APE	0.0019	0.0138	0.1683
Entamoeba histolytica	ubiquitin carboxyl-terminal hydrolase domain containing protein	0.0037	0.0428	0.2846
Brugia malayi	Ubiquitin carboxyl-terminal hydrolase family protein	0.0037	0.0428	0.1688
Trichomonas vaginalis	Importin beta-1 subunit, putative	0.0047	0.0601	0.3599
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	0.0019	0.0138	0.0138
Brugia malayi	Importin beta-1 subunit	0.0058	0.0781	0.3077
Onchocerca volvulus	Alhambra homolog	0.003	0.0318	1
Leishmania major	importin beta-1 subunit, putative	0.0047	0.0601	0.2343
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0053	0.069	0.8821
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0096	0.1402	0.1402
Schistosoma mansoni	protein phosphatase 2C	0.0025	0.0241	0.0241
Echinococcus granulosus	Jumonji AT rich interactive domain 1B	0.0027	0.0267	0.0267
Echinococcus multilocularis	expressed conserved protein	0.0095	0.1384	0.1384
Echinococcus multilocularis	jumonji domain containing protein	0.0042	0.051	0.051
Echinococcus multilocularis	ubiquitin carboxyl terminal hydrolase 8	0.0037	0.0428	0.0428
Loa Loa (eye worm)	hypothetical protein	0.0111	0.1654	0.1654
Toxoplasma gondii	HEAT repeat-containing protein	0.0058	0.0781	1
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0048	0.0611	0.0611
Brugia malayi	F/Y-rich N-terminus family protein	0.0018	0.0127	0.0501
Trichomonas vaginalis	conserved hypothetical protein	0.0111	0.1654	1
Schistosoma mansoni	hypothetical protein	0.062	1	1
Treponema pallidum	exodeoxyribonuclease (exoA)	0.0019	0.0138	0.5
Echinococcus multilocularis	lysine specific demethylase 5A	0.0094	0.1376	0.1376
Mycobacterium tuberculosis	Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI)	0.0019	0.0138	0.5
Plasmodium vivax	hypothetical protein, conserved	0.003	0.0318	0.401
Echinococcus granulosus	GPCR family 2	0.0048	0.0611	0.0611
Schistosoma mansoni	ap endonuclease	0.0019	0.0138	0.0138
Echinococcus granulosus	Niemann Pick C1 protein	0.0101	0.1485	0.1485
Giardia lamblia	PHD finger protein 15	0.003	0.0318	0.1872
Brugia malayi	jmjC domain containing protein	0.0096	0.1402	0.5525
Schistosoma mansoni	hypothetical protein	0.0171	0.2623	0.2623
Leishmania major	3-hydroxy-3-methylglutaryl-CoA reductase	0.0165	0.2537	1
Echinococcus multilocularis	DNA (apurinic or apyrimidinic site) lyase	0.0019	0.0138	0.0138
Schistosoma mansoni	hydroxymethylglutaryl-CoA reductase (NADPH)	0.0165	0.2537	0.2537
Schistosoma mansoni	cpg binding protein	0.0029	0.0309	0.0309
Schistosoma mansoni	hypothetical protein	0.0048	0.0611	0.0611
Plasmodium vivax	importin-beta 2, putative	0.0058	0.0781	1
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0092	0.1331	0.5245
Echinococcus granulosus	ubiquitin carboxyl terminal hydrolase 8	0.0037	0.0428	0.0428
Brugia malayi	Niemann-Pick C1 protein precursor	0.0101	0.1485	0.5851
Echinococcus multilocularis	Peptidase C19, ubiquitin carboxyl terminal hydrolase 2	0.0037	0.0428	0.0428
Echinococcus granulosus	jumonji domain containing 1A	0.0025	0.0241	0.0241
Schistosoma mansoni	jumonji domain containing protein	0.0025	0.0241	0.0241
Schistosoma mansoni	hypothetical protein	0.0048	0.0611	0.0611
Brugia malayi	jmjC domain containing protein	0.0025	0.0241	0.0949
Trypanosoma cruzi	3-hydroxy-3-methylglutaryl-CoA reductase, putative	0.0165	0.2537	1
Echinococcus granulosus	ubiquitin specific protease 41	0.0037	0.0428	0.0428
Echinococcus granulosus	transportin 1	0.0011	0.0008	0.0008
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0096	0.1402	0.1402
Schistosoma mansoni	ap endonuclease	0.0019	0.0138	0.0138
Loa Loa (eye worm)	hypothetical protein	0.003	0.0318	0.0318
Loa Loa (eye worm)	hypothetical protein	0.0101	0.1485	0.1485
Trypanosoma brucei	GTP-binding nuclear protein rtb2, putative	0.0043	0.0529	0.2061
Wolbachia endosymbiont of Brugia malayi	exonuclease III	0.0019	0.0138	0.5
Brugia malayi	exodeoxyribonuclease III family protein	0.0019	0.0138	0.0545
Echinococcus granulosus	cpg binding protein	0.0029	0.0309	0.0309
Brugia malayi	kap beta 3 protein	0.0011	0.0008	0.0032
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0151	0.2302	0.9072
Echinococcus granulosus	Transcription factor JmjC domain containing protein	0.0156	0.2388	0.2388
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0092	0.1331	0.1331
Echinococcus granulosus	sterol regulatory element binding protein	0.0111	0.1654	0.1654
Leishmania major	apurinic/apyrimidinic endonuclease-redox protein	0.0019	0.0138	0.0514
Trichomonas vaginalis	3-hydroxy-3-methylglutaryl-coenzyme A reductase, putative	0.0078	0.1099	0.6626
Plasmodium vivax	JmjC domain containing protein	0.0025	0.0241	0.3011
Schistosoma mansoni	niemann-pick C1 (NPC1)	0.0171	0.2626	0.2626
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0059	0.0793	0.0793
Loa Loa (eye worm)	hypothetical protein	0.0058	0.0781	0.0781
Giardia lamblia	GTP-binding nuclear protein RAN/TC4	0.0043	0.0529	0.4071
Brugia malayi	jmjC domain containing protein	0.0156	0.2388	0.941
Trypanosoma cruzi	importin beta-1 subunit, putative	0.0047	0.0601	0.1928
Trichomonas vaginalis	conserved hypothetical protein	0.0037	0.0428	0.2553
Brugia malayi	RNA, U transporter 1	0.0165	0.2538	1
Trypanosoma brucei	JmjC domain, hydroxylase, putative	0.0025	0.0241	0.092
Plasmodium falciparum	phd finger protein, putative	0.003	0.0318	0.401
Leishmania major	GTP-binding protein, putative	0.0043	0.0529	0.2061
Echinococcus multilocularis	jumonji domain containing 1A	0.0025	0.0241	0.0241
Echinococcus multilocularis	protein patched	0.0111	0.1654	0.1654
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0048	0.0611	0.0611
Trichomonas vaginalis	3-hydroxy-3-methylglutaryl-coenzyme A reductase, putative	0.0078	0.1099	0.6626
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0017	0.0101	0.0101
Echinococcus multilocularis	lysine specific demethylase 6a	0.0025	0.0241	0.0241
Brugia malayi	PHD-finger family protein	0.0011	0.0014	0.0055
Schistosoma mansoni	hypothetical protein	0.0048	0.0611	0.0611
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0151	0.2302	0.2302
Toxoplasma gondii	histone lysine demethylase JMJC1/KDM5D/JARID1D	0.0025	0.0241	0.3011
Trichomonas vaginalis	Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase	0.0037	0.0428	0.2553
Echinococcus granulosus	Peptidase C19 ubiquitin carboxyl terminal hydrolase 2	0.0037	0.0428	0.0428
Giardia lamblia	Ubiquitin carboxyl-terminal hydrolase 4	0.0037	0.0428	0.3021
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0092	0.1331	0.1331
Trypanosoma brucei	apurinic/apyrimidinic endonuclease, putative	0.0019	0.0138	0.0514
Loa Loa (eye worm)	hypothetical protein	0.0067	0.0923	0.0923
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0092	0.1331	0.1331
Plasmodium falciparum	GTP-binding nuclear protein RAN/TC4	0.0043	0.0529	0.6744
Schistosoma mansoni	importin-beta 2	0.0011	0.0008	0.0008
Trypanosoma cruzi	JmjC domain, hydroxylase, putative	0.0025	0.0241	0.0428
Trypanosoma cruzi	ubiquitin carboxyl-terminal hydrolase, putative	0.0037	0.0428	0.121
Echinococcus multilocularis	GTP binding nuclear protein Ran	0.0043	0.0529	0.0529
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0028	0.0283	0.0283
Trichomonas vaginalis	ap endonuclease, putative	0.0019	0.0138	0.079
Loa Loa (eye worm)	GTP-binding nuclear protein RAN/TC4	0.0043	0.0529	0.0529
Trichomonas vaginalis	ran, putative	0.0043	0.0529	0.3166
Loa Loa (eye worm)	hypothetical protein	0.0011	0.0014	0.0014
Loa Loa (eye worm)	jmjC domain-containing protein	0.0025	0.0241	0.0241
Loa Loa (eye worm)	abnormal chemotaxis protein 14	0.0111	0.1654	0.1654
Brugia malayi	PHD-finger family protein	0.003	0.0318	0.1253
Loa Loa (eye worm)	transcription factor SMAD2	0.0121	0.1812	0.1812
Trichomonas vaginalis	Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase	0.0037	0.0428	0.2553
Echinococcus multilocularis	hydroxymethylglutaryl coenzyme A reductase	0.0165	0.2537	0.2537
Echinococcus granulosus	JmjC domain containing protein 4	0.0025	0.0241	0.0241
Echinococcus granulosus	phd:f box containing protein	0.0025	0.0241	0.0241
Echinococcus multilocularis	snurportin 1	0.062	1	1
Echinococcus granulosus	jumonji domain containing protein	0.0042	0.051	0.051
Schistosoma mansoni	ran	0.0043	0.0529	0.0529
Trypanosoma brucei	3-hydroxy-3-methylglutaryl-CoA reductase, putative	0.0165	0.2537	1
Echinococcus multilocularis	importin 5	0.0011	0.0008	0.0008
Echinococcus granulosus	Protein patched homolog 1	0.0111	0.1654	0.1654
Brugia malayi	jmjC domain containing protein	0.0025	0.0241	0.0949
Echinococcus multilocularis	transportin 1	0.0011	0.0008	0.0008
Echinococcus multilocularis	Niemann Pick C1 protein	0.0101	0.1485	0.1485
Brugia malayi	GTP-binding nuclear protein RAN/TC4	0.0043	0.0529	0.2086
Leishmania major	ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative	0.0037	0.0428	0.1662
Trypanosoma cruzi	GTP-binding nuclear protein rtb2, putative	0.0043	0.0529	0.163
Echinococcus multilocularis	ubiquitin specific protease 41	0.0037	0.0428	0.0428
Trypanosoma cruzi	GTP-binding nuclear protein rtb2, putative	0.0043	0.0529	0.163
Loa Loa (eye worm)	hypothetical protein	0.0165	0.2537	0.2537
Toxoplasma gondii	PHD-finger domain-containing protein	0.003	0.0318	0.401
Schistosoma mansoni	phosphatidylserine receptor	0.0025	0.0241	0.0241
Schistosoma mansoni	ubiquitously transcribed sex (X/Y) chromosome tetratricopeptide repeat protein-related	0.0025	0.0241	0.0241
Schistosoma mansoni	ubiquitin-specific peptidase 8 (C19 family)	0.0037	0.0428	0.0428
Loa Loa (eye worm)	hypothetical protein	0.0053	0.0699	0.0699
Loa Loa (eye worm)	jmjC domain-containing protein	0.0062	0.084	0.084
Schistosoma mansoni	hypothetical protein	0.0171	0.2623	0.2623
Plasmodium vivax	hypothetical protein, conserved	0.0011	0.0016	0.01
Leishmania major	hypothetical protein, conserved	0.0025	0.0241	0.092
Echinococcus granulosus	lysine specific demethylase 5A	0.0096	0.1402	0.1402
Loa Loa (eye worm)	jmjC domain-containing protein	0.0096	0.1402	0.1402
Entamoeba histolytica	exodeoxyribonuclease III, putative	0.0019	0.0138	0.0881
Echinococcus multilocularis	Transcription factor, JmjC domain containing protein	0.0156	0.2388	0.2388
Plasmodium falciparum	conserved Plasmodium membrane protein, unknown function	0.0011	0.0016	0.01
Toxoplasma gondii	PHD-finger domain-containing protein	0.003	0.0318	0.401
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0241	0.0241
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0151	0.2302	0.9072
Echinococcus granulosus	lysine specific demethylase 6a	0.0025	0.0241	0.0241
Schistosoma mansoni	importin beta-1	0.0058	0.0781	0.0781
Echinococcus granulosus	translational activator gcn1	0.0011	0.0008	0.0008
Entamoeba histolytica	hypothetical protein	0.0047	0.0601	0.4012
Echinococcus granulosus	PHD finger protein rhinoceros	0.003	0.0318	0.0318
Trypanosoma cruzi	3-hydroxy-3-methylglutaryl-CoA reductase	0.0165	0.2537	1
Loa Loa (eye worm)	hypothetical protein	0.0151	0.2302	0.2302
Toxoplasma gondii	histone lysine demethylase JMJD6a	0.0025	0.0241	0.3011
Echinococcus multilocularis	PHD finger protein rhinoceros	0.003	0.0318	0.0318
Schistosoma mansoni	hypothetical protein	0.003	0.0318	0.0318
Plasmodium falciparum	JmjC domain-containing protein, putative	0.0025	0.0241	0.3011
Brugia malayi	MH2 domain containing protein	0.0121	0.1812	0.7141
Loa Loa (eye worm)	hypothetical protein	0.0048	0.0611	0.0611
Schistosoma mansoni	ran	0.0043	0.0529	0.0529
Schistosoma mansoni	hypothetical protein	0.0048	0.0611	0.0611
Echinococcus multilocularis	cpg binding protein	0.0029	0.0309	0.0309
Schistosoma mansoni	hypothetical protein	0.0042	0.0513	0.0513
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0092	0.1331	0.1331
Echinococcus multilocularis	importin subunit beta 1	0.0058	0.0781	0.0781
Trypanosoma brucei	importin beta-1 subunit, putative	0.0058	0.0781	0.3055
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0092	0.1331	0.1331
Schistosoma mansoni	jumonji domain containing protein	0.0136	0.2058	0.2058
Trypanosoma cruzi	ubiquitin carboxyl-terminal hydrolase, putative	0.0037	0.0428	0.121
Echinococcus granulosus	GTP binding nuclear protein Ran	0.0043	0.0529	0.0529
Schistosoma mansoni	hypothetical protein	0.0042	0.0513	0.0513
Trypanosoma brucei	ubiquitin carboxyl-terminal hydrolase, putative	0.0037	0.0428	0.1662
Schistosoma mansoni	patched 1	0.0111	0.1654	0.1654
Mycobacterium ulcerans	hydroxymethylglutaryl-coenzyme a (HMG-CoA) reductase	0.0165	0.2537	1
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0241	0.0241
Brugia malayi	Bromodomain containing protein	0.003	0.0318	0.1253
Schistosoma mansoni	hypothetical protein	0.0042	0.0513	0.0513
Echinococcus multilocularis	protein dispatched 1	0.0118	0.1755	0.1755
Brugia malayi	CHE-14 protein	0.0111	0.1654	0.6519
Brugia malayi	Hydroxymethylglutaryl-coenzyme A reductase family protein	0.0165	0.2537	0.9997
Echinococcus multilocularis	Niemann Pick C1 protein	0.0212	0.3311	0.3311
Plasmodium falciparum	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0019	0.0138	0.1683
Loa Loa (eye worm)	kap beta 3 protein	0.0011	0.0008	0.0008
Plasmodium vivax	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0019	0.0138	0.1683
Entamoeba histolytica	Ran family GTPase	0.0043	0.0529	0.3529
Echinococcus granulosus	importin subunit beta 1	0.0058	0.0781	0.0781
Echinococcus granulosus	DNA apurinic or apyrimidinic site lyase	0.0019	0.0138	0.0138
Echinococcus granulosus	expressed conserved protein	0.0095	0.1384	0.1384
Trichomonas vaginalis	Importin beta-1 subunit, putative	0.0047	0.0601	0.3599
Brugia malayi	Latrophilin receptor protein 2	0.0048	0.0611	0.2407
Brugia malayi	CXXC zinc finger family protein	0.0028	0.0283	0.1114
Schistosoma mansoni	bromodomain-containing nuclear protein 1 brd1	0.003	0.0318	0.0318
Echinococcus multilocularis	JmjC domain containing protein 4	0.0025	0.0241	0.0241
Giardia lamblia	3-hydroxy-3-methylglutaryl-coenzyme A reductase	0.0078	0.1099	1
Echinococcus multilocularis	Jumonji, AT rich interactive domain 1B	0.0027	0.0267	0.0267
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0428	0.0428
Loa Loa (eye worm)	nucleolar RNA-associated protein alpha	0.062	1	1
Trichomonas vaginalis	3-hydroxy-3-methylglutaryl-coenzyme A reductase, putative	0.0078	0.1099	0.6626
Schistosoma mansoni	phd/f-box containing protein	0.0025	0.0241	0.0241
Echinococcus multilocularis	sterol regulatory element binding protein	0.0111	0.1654	0.1654
Loa Loa (eye worm)	jmjC domain-containing protein	0.0025	0.0241	0.0241
Schistosoma mansoni	cpg binding protein	0.0029	0.0309	0.0309
Echinococcus multilocularis	phd:f box containing protein	0.0025	0.0241	0.0241
Onchocerca volvulus		0.0028	0.0283	0.8893
Echinococcus granulosus	hydroxymethylglutaryl coenzyme A reductase	0.0165	0.2537	0.2537

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 6.95 uM	Inhibition of HMG-CoA reductase by spectrophotometry	ChEMBL.	20494585

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: CHEMBL1164157

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1136885