TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 391.288 | Formula: C21H20Cl2O3
H donors: 1 H acceptors: 2 LogP: 5.35 Rotable bonds: 3
Rule of 5 violations (Lipinski): 1
SMILES: O[C@H]1C[C@H](/C=C/c2c(Cl)cc(cc2c2cc(C)cc(c2)C)Cl)OC(=O)C1
InChi: 1S/C21H20Cl2O3/c1-12-5-13(2)7-14(6-12)19-8-15(22)9-20(23)18(19)4-3-17-10-16(24)11-21(25)26-17/h3-9,16-17,24H,10-11H2,1-2H3/b4-3+/t16-,17?/m1/s1
InChiKey: LSLFRLOUXYMRHW-BACRFPFPSA-N

Network

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Target Layer

Model Organisms

Species	Viewmode
Arabidopsis thaliana
Caenorhabditis elegans
Dictyostelium discoideum
Drosophila melanogaster
Escherichia coli
Homo sapiens
Mus musculus
Oryza sativa
Saccharomyces cerevisiae
Schmidtea mediterranea
Other organisms

TDR Pathogens:

Species	Viewmode
Brugia malayi
Chlamydia trachomatis
Echinococcus granulosus
Entamoeba histolytica
Echinococcus multilocularis
Giardia lamblia
Leishmania major
Loa Loa (eye worm)
Mycobacterium leprae
Mycobacterium tuberculosis
Mycobacterium ulcerans
Onchocerca volvulus
Plasmodium falciparum
Plasmodium vivax
Schistosoma mansoni
Trypanosoma brucei
Trypanosoma cruzi
Toxoplasma gondii
Treponema pallidum
Trichomonas vaginalis
Wolbachia endosymbiont of Brugia malayi

Other Pathogens:

Species	Viewmode
Babesia bovis
Candida albicans
Cryptosporidium hominis
Cryptosporidium parvum
Leishmania braziliensis
Leishmania donovani
Leishmania infantum
Leishmania mexicana
Neospora caninum
Plasmodium berghei
Plasmodium knowlesi
Plasmodium yoelii
Schistosoma japonicum
Trypanosoma brucei gambiense
Trypanosoma congolense
Theileria parva

Compound Layer

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Clustering layers

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology

No druggable targets predicted by orthology data

By sequence similarity to non orthologous known druggable targets

No druggable targets predicted by sequence similarity

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0032	0.0184	0.0217
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0048	0.0057
Plasmodium vivax	glutathione reductase, putative	0.0056	0.0483	0.0537
Loa Loa (eye worm)	TK/FER protein kinase	0.0022	0.0061	0.0071
Giardia lamblia	Kinase, CMGC CDK	0.0706	0.85	1
Onchocerca volvulus		0.0043	0.0317	0.7856
Brugia malayi	hypothetical protein	0.003	0.0158	0.0186
Mycobacterium ulcerans	long-chain-fatty-acid--CoA ligase	0.0028	0.0136	0.0116
Loa Loa (eye worm)	variant SH3 domain-containing protein	0.0018	0.0012	0.0015
Entamoeba histolytica	cell division protein kinase 2, putative	0.0706	0.85	1
Brugia malayi	Tyrosine-protein kinase abl-1	0.0026	0.0106	0.0125
Echinococcus granulosus	thioredoxin glutathione reductase	0.0056	0.0483	0.0555
Trypanosoma brucei	PAB1-binding protein , putative	0.003	0.0158	0.0163
Echinococcus multilocularis	cyclins	0.003	0.0161	0.0175
Schistosoma mansoni	hydroxymethylglutaryl-CoA reductase (NADPH)	0.0165	0.1827	0.2138
Trypanosoma cruzi	3-hydroxy-3-methylglutaryl-CoA reductase	0.0165	0.1827	0.2131
Brugia malayi	hypothetical protein	0.0145	0.1579	0.1858
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.0055	0.0468	0.0537
Echinococcus multilocularis	tyrosine protein kinase Blk	0.0051	0.0422	0.0483
Echinococcus granulosus	cyclin b3	0.003	0.0161	0.0175
Echinococcus multilocularis	cyclin dependent kinase 1	0.0706	0.85	1
Plasmodium vivax	ataxin-2 like protein, putative	0.003	0.0158	0.0153
Schistosoma mansoni	tyrosine kinase	0.0026	0.0106	0.011
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0048	0.0057
Schistosoma mansoni	tyrosine kinase	0.0251	0.2883	0.3382
Echinococcus granulosus	cyclin B	0.0049	0.0387	0.0442
Echinococcus multilocularis	cyclins	0.003	0.0161	0.0175
Leishmania major	cell division protein kinase 2,cdc2-related kinase	0.0706	0.85	1
Mycobacterium tuberculosis	Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras	0.0143	0.1552	0.1528
Loa Loa (eye worm)	TK/ABL protein kinase	0.0022	0.0061	0.0071
Loa Loa (eye worm)	TK/FAK protein kinase	0.0254	0.2918	0.3433
Leishmania major	3-hydroxy-3-methylglutaryl-CoA reductase	0.0165	0.1827	0.2131
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0136	0.016
Echinococcus multilocularis	cyclin B	0.0049	0.0387	0.0442
Trichomonas vaginalis	cyclin D, putative	0.003	0.0161	0.0156
Trypanosoma cruzi	cdc2-related kinase 1	0.0706	0.85	1
Echinococcus granulosus	sodium channel protein	0.0045	0.034	0.0385
Leishmania major	4-coumarate:coa ligase-like protein	0.0028	0.0136	0.0137
Schistosoma mansoni	tyrosine kinase	0.0227	0.2593	0.304
Mycobacterium tuberculosis	Probable oxidoreductase	0.0143	0.1552	0.1528
Loa Loa (eye worm)	TK/FER protein kinase	0.0022	0.0061	0.0071
Echinococcus granulosus	voltage gated sodium channel Nav1 alpha subunit	0.0045	0.034	0.0385
Echinococcus granulosus	cyclins	0.003	0.0161	0.0175
Plasmodium vivax	protein kinase Crk2	0.0706	0.85	1
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.002	0.0029	0.0009
Leishmania major	4-coumarate:coa ligase-like protein	0.0028	0.0136	0.0137
Trichomonas vaginalis	3-hydroxy-3-methylglutaryl-coenzyme A reductase, putative	0.0078	0.0744	0.0845
Mycobacterium ulcerans	long-chain fatty-acid CoA ligase	0.0028	0.0136	0.0116
Trypanosoma cruzi	CYC2-like cyclin, putative	0.0049	0.0387	0.0433
Echinococcus granulosus	sterol regulatory element binding protein	0.0068	0.0627	0.0724
Loa Loa (eye worm)	TK/FER protein kinase	0.0022	0.0061	0.0071
Loa Loa (eye worm)	TK/FER protein kinase	0.0022	0.0061	0.0071
Echinococcus multilocularis	cyclins	0.003	0.0161	0.0175
Trypanosoma cruzi	STE group serine/threonine-protein kinase, putative	0.0023	0.0067	0.0054
Brugia malayi	SRC-1	0.0055	0.0468	0.0551
Schistosoma mansoni	tyrosine kinase	0.0055	0.0468	0.0537
Echinococcus granulosus	single minded 2	0.0043	0.0317	0.0359
Schistosoma mansoni	tyrosine kinase	0.0026	0.0106	0.011
Mycobacterium tuberculosis	Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase)	0.0028	0.0136	0.0108
Onchocerca volvulus		0.0028	0.0136	0.2317
Entamoeba histolytica	cyclin family protein	0.003	0.0161	0.012
Schistosoma mansoni	intermediate filament proteins	0.0032	0.0184	0.0202
Trichomonas vaginalis	flap endonuclease-1, putative	0.0031	0.0171	0.0168
Mycobacterium ulcerans	acyl-CoA synthetase	0.0028	0.0136	0.0116
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.002	0.0029	0.0009
Brugia malayi	Cyclin, N-terminal domain containing protein	0.003	0.0161	0.0189
Echinococcus granulosus	tyrosine protein kinase ABL1	0.0022	0.0061	0.0057
Echinococcus multilocularis	cyclin dependent kinase 5	0.0706	0.85	1
Leishmania major	cyclin	0.0049	0.0387	0.0433
Loa Loa (eye worm)	thioredoxin reductase	0.0056	0.0483	0.0569
Trichomonas vaginalis	CMGC family protein kinase	0.0706	0.85	1
Giardia lamblia	Cyclin A	0.003	0.0161	0.0156
Brugia malayi	dihydrolipoyl dehydrogenase, mitochondrial precursor, putative	0.002	0.0029	0.0034
Echinococcus multilocularis	G2:mitotic specific cyclin B3	0.003	0.0161	0.0175
Loa Loa (eye worm)	TK protein kinase	0.0051	0.0422	0.0497
Trypanosoma cruzi	STE group serine/threonine-protein kinase, putative	0.0023	0.0067	0.0054
Brugia malayi	Protein kinase domain containing protein	0.0022	0.0061	0.0071
Brugia malayi	AMP-binding enzyme family protein	0.0028	0.0136	0.016
Schistosoma mansoni	tyrosine kinase	0.0022	0.0061	0.0057
Brugia malayi	Variant SH3 domain containing protein	0.0018	0.0012	0.0015
Loa Loa (eye worm)	flap endonuclease-1	0.0031	0.0171	0.0201
Trypanosoma cruzi	3-hydroxy-3-methylglutaryl-CoA reductase, putative	0.0165	0.1827	0.2131
Trichomonas vaginalis	CMGC family protein kinase	0.0706	0.85	1
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0028	0.0136	0.009
Trypanosoma cruzi	cdc2-related kinase 3	0.0706	0.85	1
Entamoeba histolytica	cyclin family protein	0.003	0.0161	0.012
Trypanosoma brucei	cdc2-related kinase 1	0.0706	0.85	1
Plasmodium vivax	acyl-CoA synthetase, putative	0.0021	0.0048	0.0023
Brugia malayi	Cyclin, N-terminal domain containing protein	0.0235	0.2693	0.3168
Loa Loa (eye worm)	hypothetical protein	0.0698	0.8407	0.989
Schistosoma mansoni	serine/threonine protein kinase	0.0706	0.85	1
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0014	0.0016
Leishmania major	cell division related protein kinase 2,cdc2-related kinase	0.0706	0.85	1
Echinococcus granulosus	cyclin dependent kinase 1	0.0706	0.85	1
Loa Loa (eye worm)	cytochrome P450 family protein	0.0019	0.0021	0.0024
Leishmania major	CYC2-like cyclin, putative,cyclin 6, putative	0.0049	0.0387	0.0433
Echinococcus granulosus	cyclins	0.003	0.0161	0.0175
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.002	0.0034	0.0005
Schistosoma mansoni	niemann-pick C1 (NPC1)	0.0068	0.0627	0.0724
Loa Loa (eye worm)	hypothetical protein	0.0505	0.6022	0.7084
Loa Loa (eye worm)	cyclin domain-containing protein	0.0235	0.2693	0.3168
Loa Loa (eye worm)	CMGC/CDK/CDK5 protein kinase	0.0706	0.85	1
Leishmania major	2-oxoglutarate dehydrogenase, e3 component, lipoamidedehydrogenase-like protein	0.002	0.0029	0.0009
Trichomonas vaginalis	cyclin B, putative	0.0049	0.0387	0.0424
Mycobacterium tuberculosis	Probable reductase	0.0129	0.1375	0.135
Loa Loa (eye worm)	TK/FER protein kinase	0.0022	0.0061	0.0071
Echinococcus granulosus	tyrosine protein kinase Srms	0.0022	0.0061	0.0057
Echinococcus granulosus	lamin dm0	0.0032	0.0184	0.0202
Echinococcus granulosus	cyclin B3 1	0.003	0.0161	0.0175
Schistosoma mansoni	flap endonuclease-1	0.0028	0.0134	0.0143
Plasmodium vivax	flap endonuclease 1, putative	0.0031	0.0171	0.0168
Giardia lamblia	G2/mitotic-specific cyclin B	0.0049	0.0387	0.0424
Loa Loa (eye worm)	sex muscle abnormal protein 5	0.0018	0.0012	0.0015
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0048	0.0057
Echinococcus granulosus	tyrosine protein kinase Lyn	0.0063	0.0561	0.0646
Entamoeba histolytica	cyclin, putative	0.003	0.0161	0.012
Echinococcus granulosus	Niemann Pick C1 protein	0.0068	0.0627	0.0724
Brugia malayi	hypothetical protein	0.0022	0.0061	0.0071
Loa Loa (eye worm)	abnormal chemotaxis protein 14	0.0068	0.0627	0.0738
Echinococcus multilocularis	tyrosine protein kinase lyn tyrosine protein kinase blk	0.0055	0.0468	0.0537
Echinococcus granulosus	dihydrolipoamide dehydrogenase	0.002	0.0029	0.0019
Plasmodium falciparum	flap endonuclease 1	0.0031	0.0171	0.0168
Brugia malayi	PAS domain containing protein	0.0058	0.0503	0.0592
Trypanosoma cruzi	dihydrolipoyl dehydrogenase, putative	0.002	0.0029	0.0009
Schistosoma mansoni	cyclins	0.003	0.0161	0.0175
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0012	0.0015
Schistosoma mansoni	patched 1	0.0068	0.0627	0.0724
Trichomonas vaginalis	3-hydroxy-3-methylglutaryl-coenzyme A reductase, putative	0.0078	0.0744	0.0845
Echinococcus granulosus	5'partial\|cyclin dependent kinase 1	0.0706	0.85	1
Loa Loa (eye worm)	hypoxia-induced factor 1	0.018	0.2004	0.2357
Trypanosoma cruzi	PAB1-binding protein , putative	0.003	0.0158	0.0163
Echinococcus multilocularis	Niemann Pick C1 protein	0.0068	0.0627	0.0724
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.002	0.0029	0.0009
Entamoeba histolytica	cyclin, putative	0.0049	0.0387	0.0388
Trichomonas vaginalis	cyclins, putative	0.0049	0.0387	0.0424
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.002	0.0029	0.0009
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.0055	0.0468	0.0537
Trypanosoma cruzi	trypanothione reductase, putative	0.0056	0.0483	0.0546
Trypanosoma brucei	dihydrolipoamide dehydrogenase, point mutation	0.002	0.0029	0.0009
Echinococcus granulosus	tyrosine protein kinase Fps85D	0.0022	0.0061	0.0057
Brugia malayi	intermediate filament protein	0.0032	0.0184	0.0217
Trypanosoma cruzi	trypanothione reductase, putative	0.002	0.0029	0.0009
Trypanosoma brucei	dihydrolipoamide dehydrogenase	0.002	0.0029	0.0009
Trichomonas vaginalis	cyclin B, putative	0.0049	0.0387	0.0424
Trichomonas vaginalis	conserved hypothetical protein	0.0068	0.0627	0.0707
Echinococcus multilocularis	protein patched	0.0068	0.0627	0.0724
Echinococcus multilocularis	tyrosine protein kinase Fps85D	0.0022	0.0061	0.0057
Brugia malayi	Thioredoxin reductase	0.0056	0.0483	0.0569
Brugia malayi	hypothetical protein	0.0019	0.0027	0.0032
Echinococcus granulosus	c src tyrosine kinase	0.0026	0.0106	0.011
Schistosoma mansoni	dihydrolipoamide dehydrogenase	0.002	0.0029	0.0019
Brugia malayi	Protein kinase domain containing protein	0.0254	0.2918	0.3433
Mycobacterium ulcerans	acyl-CoA synthetase	0.0028	0.0136	0.0116
Plasmodium falciparum	cyclin	0.003	0.0161	0.0156
Loa Loa (eye worm)	TK/FER protein kinase	0.0022	0.0061	0.0071
Mycobacterium tuberculosis	Probable membrane NADH dehydrogenase NdhA	0.0129	0.1375	0.135
Loa Loa (eye worm)	hypothetical protein	0.0165	0.1827	0.215
Leishmania major	trypanothione reductase	0.0056	0.0483	0.0546
Echinococcus granulosus	tyrosine kinase	0.0051	0.0422	0.0483
Brugia malayi	AMP-binding enzyme family protein	0.0028	0.0136	0.016
Entamoeba histolytica	cell division protein kinase 2, putative	0.0706	0.85	1
Echinococcus granulosus	cyclins	0.003	0.0161	0.0175
Loa Loa (eye worm)	hypothetical protein	0.003	0.0158	0.0186
Entamoeba histolytica	protein kinase, putative	0.0037	0.0243	0.0217
Brugia malayi	hypoxia-induced factor 1	0.018	0.2004	0.2357
Trichomonas vaginalis	cyclin D, putative	0.003	0.0161	0.0156
Brugia malayi	Protein kinase domain containing protein	0.0706	0.85	1
Trypanosoma brucei	flap endonuclease-1 (FEN-1), putative	0.0031	0.0171	0.0177
Loa Loa (eye worm)	cytochrome P450 family protein	0.0019	0.0021	0.0024
Leishmania major	flap endonuclease-1 (FEN-1), putative	0.0031	0.0171	0.0177
Echinococcus multilocularis	cyclin dependent kinase	0.0706	0.85	1
Leishmania major	dihydrolipoamide dehydrogenase, putative	0.002	0.0029	0.0009
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0177	0.0208
Echinococcus granulosus	tyrosine kinase\|tyrosine protein kinase Fyn	0.0051	0.0422	0.0483
Trypanosoma cruzi	cdc2-related kinase 3	0.0706	0.85	1
Leishmania major	dihydrolipoamide dehydrogenase, putative	0.002	0.0029	0.0009
Echinococcus multilocularis	tyrosine protein kinase Abl	0.0026	0.0106	0.011
Loa Loa (eye worm)	TK/FER protein kinase	0.0022	0.0061	0.0071
Trichomonas vaginalis	cyclins, putative	0.0049	0.0387	0.0424
Echinococcus multilocularis	lamin dm0	0.0032	0.0184	0.0202
Trichomonas vaginalis	cyclin B, putative	0.0049	0.0387	0.0424
Brugia malayi	Variant SH3 domain containing protein	0.0018	0.0012	0.0015
Giardia lamblia	Hypothetical protein	0.003	0.0161	0.0156
Trypanosoma cruzi	dihydrolipoyl dehydrogenase, putative	0.002	0.0029	0.0009
Echinococcus granulosus	tyrosine protein kinase Fyn	0.0055	0.0468	0.0537
Mycobacterium tuberculosis	Putative ferredoxin reductase	0.0129	0.1375	0.135
Loa Loa (eye worm)	hypothetical protein	0.0505	0.6022	0.7084
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0021	0.0048	0.0028
Brugia malayi	CHE-14 protein	0.0068	0.0627	0.0738
Echinococcus granulosus	lamin	0.0032	0.0184	0.0202
Mycobacterium leprae	PROBABLE NADH DEHYDROGENASE NDH	0.0129	0.1375	0.8749
Loa Loa (eye worm)	TK/FER protein kinase	0.0022	0.0061	0.0071
Echinococcus granulosus	protein tyrosine kinase	0.0251	0.2883	0.3382
Trypanosoma cruzi	STE/STE11 serine/threonine-protein kinase, putative	0.0023	0.0067	0.0054
Loa Loa (eye worm)	TK/FER protein kinase	0.0022	0.0061	0.0071
Loa Loa (eye worm)	hypothetical protein	0.0068	0.0627	0.0738
Echinococcus granulosus	tyrosine protein kinase Src42A	0.0055	0.0468	0.0537
Schistosoma mansoni	cyclin B3	0.003	0.0161	0.0175
Echinococcus granulosus	3'partial\|tyrosine protein kinase Fgr	0.0055	0.0468	0.0537
Echinococcus multilocularis	tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase	0.0055	0.0468	0.0537
Echinococcus multilocularis	tyrosine protein kinase Btk29A	0.0026	0.0106	0.011
Echinococcus multilocularis	tyrosine protein kinase Src42A	0.0055	0.0468	0.0537
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.002	0.0029	0.0009
Echinococcus multilocularis	cyclins	0.003	0.0161	0.0175
Trypanosoma cruzi	flap endonuclease-1 (FEN-1), putative	0.0031	0.0171	0.0177
Trypanosoma cruzi	cyclin 6, putative	0.0049	0.0387	0.0433
Echinococcus multilocularis	tyrosine protein kinase Src64B	0.0055	0.0468	0.0537
Echinococcus granulosus	cyclins	0.003	0.0161	0.0175
Plasmodium falciparum	ataxin-2 like protein, putative	0.003	0.0158	0.0153
Mycobacterium tuberculosis	Probable NADH dehydrogenase Ndh	0.0129	0.1375	0.135
Trichomonas vaginalis	3-hydroxy-3-methylglutaryl-coenzyme A reductase, putative	0.0078	0.0744	0.0845
Echinococcus multilocularis	cyclin b3	0.003	0.0161	0.0175
Mycobacterium leprae	DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE	0.0143	0.1552	1
Brugia malayi	Protein kinase domain containing protein	0.0022	0.0061	0.0071
Loa Loa (eye worm)	TK protein kinase	0.0037	0.0243	0.0286
Echinococcus granulosus	tyrosine protein kinase Btk29A	0.0026	0.0106	0.011
Trichomonas vaginalis	cyclins, putative	0.0026	0.0104	0.0089
Onchocerca volvulus		0.0049	0.0387	1
Echinococcus granulosus	tyrosine protein kinase Fyn	0.0055	0.0468	0.0537
Echinococcus multilocularis	tyrosine protein kinase Srms	0.0051	0.0422	0.0483
Echinococcus multilocularis	tyrosine kinase	0.0022	0.0061	0.0057
Echinococcus granulosus	cyclin dependent kinase	0.0706	0.85	1
Leishmania major	4-coumarate:coa ligase-like protein	0.0028	0.0136	0.0137
Leishmania major	hypothetical protein, conserved	0.003	0.0158	0.0163
Mycobacterium ulcerans	haloalkane dehalogenase	0.0827	1	1
Schistosoma mansoni	cyclin B	0.0049	0.0387	0.0442
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0028	0.0136	0.0116
Trypanosoma cruzi	dihydrolipoamide dehydrogenase, putative	0.002	0.0029	0.0009
Echinococcus granulosus	tyrosine protein kinase shark	0.0227	0.2593	0.304
Mycobacterium tuberculosis	NAD(P)H quinone reductase LpdA	0.0143	0.1552	0.1528
Echinococcus granulosus	cyclin dependent kinase 5	0.0706	0.85	1
Echinococcus multilocularis	c src tyrosine kinase	0.0026	0.0106	0.011
Echinococcus multilocularis	cyclins	0.003	0.0161	0.0175
Loa Loa (eye worm)	CMGC/CDK/CDC2 protein kinase	0.0706	0.85	1
Echinococcus granulosus	G2:mitotic specific cyclin B3	0.003	0.0161	0.0175
Brugia malayi	cell division control protein 2 homolog	0.0706	0.85	1
Brugia malayi	Flap endonuclease-1	0.0031	0.0171	0.0201
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.0051	0.0422	0.0483
Brugia malayi	Protein kinase domain containing protein	0.0022	0.0061	0.0071
Brugia malayi	protein-tyrosine kinase	0.0051	0.0422	0.0497
Schistosoma mansoni	tyrosine kinase	0.0213	0.2413	0.2829
Mycobacterium tuberculosis	Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.0021	0.0048	0.002
Trypanosoma brucei	cdc2-related kinase 3	0.0706	0.85	1
Brugia malayi	AMP-binding enzyme family protein	0.0028	0.0136	0.016
Echinococcus multilocularis	musashi	0.0032	0.0184	0.0202
Echinococcus multilocularis	flap endonuclease 1	0.0031	0.0171	0.0186
Trypanosoma cruzi	PAB1-binding protein , putative	0.003	0.0158	0.0163
Treponema pallidum	NADH oxidase	0.002	0.0029	0.5
Schistosoma mansoni	single-minded	0.0058	0.0503	0.0578
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0028	0.0136	0.009
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0048	0.0057
Schistosoma mansoni	serine/threonine protein kinase	0.0706	0.85	1
Schistosoma mansoni	lamin	0.0032	0.0184	0.0202
Brugia malayi	Cyclin, N-terminal domain containing protein	0.0049	0.0387	0.0456
Trypanosoma cruzi	cyclin, putative	0.0049	0.0387	0.0433
Loa Loa (eye worm)	cyclin domain-containing protein	0.003	0.0161	0.0189
Loa Loa (eye worm)	hypothetical protein	0.0195	0.219	0.2576
Leishmania major	protein kinase, putative	0.0023	0.0067	0.0054
Entamoeba histolytica	acyl-coA synthetase, putative	0.0028	0.0136	0.009
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.002	0.0034	0.0005
Brugia malayi	Cytochrome P450 family protein	0.0019	0.0021	0.0024
Mycobacterium ulcerans	long-chain-fatty-acid-CoA ligase	0.0028	0.0136	0.0116
Echinococcus multilocularis	cyclins	0.003	0.0161	0.0175
Loa Loa (eye worm)	SRC-1	0.0055	0.0468	0.0551
Echinococcus granulosus	tyrosine protein kinase Src64B	0.0055	0.0468	0.0537
Trichomonas vaginalis	cyclin A, putative	0.0049	0.0387	0.0424
Brugia malayi	Protein kinase domain containing protein	0.0022	0.0061	0.0071
Leishmania major	calcium channel protein, putative,ion transporter, putative	0.0045	0.034	0.0376
Toxoplasma gondii	flap structure-specific endonuclease 1, putative	0.0031	0.0171	0.0168
Toxoplasma gondii	hypothetical protein	0.0023	0.0071	0.005
Wolbachia endosymbiont of Brugia malayi	dihydrolipoamide dehydrogenase E3 component	0.002	0.0029	0.5
Trichomonas vaginalis	cyclins, putative	0.003	0.0161	0.0156
Trypanosoma brucei	dihydrolipoyl dehydrogenase	0.002	0.0029	0.0009
Echinococcus granulosus	Protein patched homolog 1	0.0068	0.0627	0.0724
Wolbachia endosymbiont of Brugia malayi	dihydrolipoamide dehydrogenase E3 component	0.002	0.0029	0.5
Echinococcus multilocularis	protein dispatched 1	0.0068	0.0627	0.0724
Echinococcus granulosus	tyrosine protein kinase Src42A	0.0044	0.0329	0.0373
Mycobacterium ulcerans	hydroxymethylglutaryl-coenzyme a (HMG-CoA) reductase	0.0165	0.1827	0.181
Echinococcus multilocularis	hydroxymethylglutaryl coenzyme A reductase	0.0165	0.1827	0.2138
Loa Loa (eye worm)	glutathione reductase	0.0056	0.0483	0.0569
Brugia malayi	Cytochrome P450 family protein	0.0019	0.0021	0.0024
Loa Loa (eye worm)	intermediate filament protein	0.0032	0.0184	0.0217
Mycobacterium ulcerans	dihydrolipoamide dehydrogenase, LpdB	0.002	0.0029	0.0008
Mycobacterium ulcerans	dihydrolipoamide dehydrogenase	0.002	0.0029	0.0008
Brugia malayi	SH2 domain containing protein	0.0022	0.0061	0.0071
Echinococcus granulosus	hydroxymethylglutaryl coenzyme A reductase	0.0165	0.1827	0.2138
Schistosoma mansoni	proto-oncogene tyrosine-protein kinase src	0.0026	0.0106	0.011
Echinococcus granulosus	intermediate filament protein	0.0032	0.0184	0.0202
Giardia lamblia	Flap structure-specific endonuclease	0.0031	0.0171	0.0168
Echinococcus granulosus	tyrosine protein kinase HCK	0.0037	0.0243	0.0271
Plasmodium falciparum	ataxin-2 like protein, putative	0.003	0.0158	0.0153
Mycobacterium ulcerans	flavoprotein disulfide reductase	0.002	0.0029	0.0008
Leishmania major	protein kinase, putative	0.0023	0.0067	0.0054
Echinococcus multilocularis	lamin	0.0032	0.0184	0.0202
Brugia malayi	Sex muscle abnormal protein 5	0.0018	0.0012	0.0015
Plasmodium falciparum	thioredoxin reductase	0.0056	0.0483	0.0537
Loa Loa (eye worm)	TK/FER protein kinase	0.0022	0.0061	0.0071
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0136	0.016
Echinococcus granulosus	tyrosine kinase	0.0022	0.0061	0.0057
Brugia malayi	Hydroxymethylglutaryl-coenzyme A reductase family protein	0.0165	0.1827	0.215
Loa Loa (eye worm)	CMGC/CDK/CDC2 protein kinase	0.0706	0.85	1
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0184	0.0217
Mycobacterium ulcerans	putative regulatory protein	0.0043	0.0317	0.0297
Brugia malayi	Protein kinase domain containing protein	0.0022	0.0061	0.0071
Echinococcus multilocularis	thioredoxin glutathione reductase	0.0056	0.0483	0.0555
Plasmodium falciparum	protein kinase 5	0.0706	0.85	1
Schistosoma mansoni	aryl hydrocarbon receptor	0.0058	0.0503	0.0578
Trypanosoma cruzi	cdc2-related kinase 1	0.0706	0.85	1
Brugia malayi	SH2 domain containing protein	0.0022	0.0061	0.0071
Plasmodium vivax	thioredoxin reductase, putative	0.0056	0.0483	0.0537
Giardia lamblia	Kinase, CMGC CDK	0.0706	0.85	1
Echinococcus multilocularis	protein tyrosine kinase	0.0251	0.2883	0.3382
Echinococcus multilocularis	sodium channel protein	0.0045	0.034	0.0385
Echinococcus multilocularis	tyrosine protein kinase ABL1	0.0022	0.0061	0.0057
Echinococcus multilocularis	tyrosine protein kinase HCK	0.0037	0.0243	0.0271
Echinococcus multilocularis	cyclin dependent kinase 1	0.0706	0.85	1
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.0055	0.0468	0.0537
Onchocerca volvulus		0.0032	0.0184	0.3785
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.002	0.0034	0.0005
Plasmodium falciparum	acyl-CoA synthetase	0.0021	0.0048	0.0023
Mycobacterium ulcerans	hypothetical protein	0.0028	0.0136	0.0116
Loa Loa (eye worm)	CYP4Cod1	0.0019	0.0021	0.0024
Schistosoma mansoni	tyrosine kinase	0.0055	0.0468	0.0537
Trypanosoma cruzi	STE/STE11 serine/threonine-protein kinase, putative	0.0023	0.0067	0.0054
Loa Loa (eye worm)	hypothetical protein	0.0049	0.0387	0.0456
Brugia malayi	Cyclin, N-terminal domain containing protein	0.0049	0.0387	0.0456
Loa Loa (eye worm)	hypothetical protein	0.0378	0.4457	0.5243
Brugia malayi	glutathione reductase	0.0056	0.0483	0.0569
Echinococcus multilocularis	tyrosine protein kinase Fgr	0.0055	0.0468	0.0537
Trichomonas vaginalis	cyclin B, putative	0.0049	0.0387	0.0424
Echinococcus granulosus	cyclins	0.003	0.0161	0.0175
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0136	0.016
Trichomonas vaginalis	CMGC family protein kinase	0.0706	0.85	1
Echinococcus multilocularis	proto oncogene tyrosine protein kinase LCK	0.0055	0.0468	0.0537
Brugia malayi	Intermediate filament tail domain containing protein	0.0032	0.0184	0.0217
Echinococcus granulosus	proto oncogene tyrosine protein kinase LCK	0.0055	0.0468	0.0537
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.002	0.0034	0.0005
Trypanosoma cruzi	cyclin, putative	0.0049	0.0387	0.0433
Trichomonas vaginalis	cyclins, putative	0.0049	0.0387	0.0424
Echinococcus multilocularis	dihydrolipoamide dehydrogenase	0.002	0.0029	0.0019
Schistosoma mansoni	lamin	0.0032	0.0184	0.0202
Mycobacterium tuberculosis	Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB	0.0129	0.1375	0.135
Echinococcus granulosus	flap endonuclease 1	0.0031	0.0171	0.0186
Onchocerca volvulus		0.0032	0.0184	0.3785
Echinococcus multilocularis	tyrosine protein kinase shark	0.0227	0.2593	0.304
Echinococcus multilocularis	cyclin B3 1	0.003	0.0161	0.0175
Trichomonas vaginalis	cyclin B, putative	0.003	0.0161	0.0156
Echinococcus multilocularis	sterol regulatory element binding protein	0.0068	0.0627	0.0724
Trichomonas vaginalis	cyclins, putative	0.0049	0.0387	0.0424
Loa Loa (eye worm)	hypothetical protein	0.0049	0.0387	0.0456
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0048	0.0057
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0028	0.0136	0.0108
Plasmodium falciparum	glutathione reductase	0.0056	0.0483	0.0537
Leishmania major	acetoin dehydrogenase e3 component-like protein	0.002	0.0029	0.0009
Toxoplasma gondii	LsmAD domain-containing protein	0.003	0.0158	0.0153
Trypanosoma brucei	trypanothione reductase	0.0056	0.0483	0.0546
Entamoeba histolytica	Flap nuclease, putative	0.0031	0.0171	0.0131
Entamoeba histolytica	SH2-protein kinase domain containing protein	0.0022	0.0061	0.0001
Toxoplasma gondii	cell-cycle-associated protein kinase CDK, putative	0.0706	0.85	1
Echinococcus multilocularis	tyrosine protein kinase Src42A	0.0044	0.0329	0.0373
Mycobacterium tuberculosis	NADPH-dependent mycothiol reductase Mtr	0.0056	0.0483	0.0456
Brugia malayi	hypothetical protein	0.0195	0.219	0.2576
Echinococcus granulosus	tyrosine protein kinase Fyn	0.0055	0.0468	0.0537
Trypanosoma brucei	dihydrolipoamide dehydrogenase	0.002	0.0029	0.0009
Mycobacterium tuberculosis	Probable dehydrogenase	0.0129	0.1375	0.135
Brugia malayi	bHLH-PAS transcription factor	0.0043	0.0317	0.0373
Trichomonas vaginalis	cyclin B3, putative	0.003	0.0161	0.0156
Trypanosoma brucei	3-hydroxy-3-methylglutaryl-CoA reductase, putative	0.0165	0.1827	0.2131
Toxoplasma gondii	thioredoxin reductase	0.0056	0.0483	0.0537
Giardia lamblia	3-hydroxy-3-methylglutaryl-coenzyme A reductase	0.0078	0.0744	0.0845
Echinococcus multilocularis	cyclins	0.003	0.0161	0.0175
Trichomonas vaginalis	conserved hypothetical protein	0.003	0.0161	0.0156
Echinococcus granulosus	tyrosine protein kinase Blk	0.0051	0.0422	0.0483
Chlamydia trachomatis	acylglycerophosphoethanolamine acyltransferase	0.0021	0.0048	1
Mycobacterium ulcerans	acyl-CoA synthetase	0.0028	0.0136	0.0116
Trypanosoma brucei	mitotic cyclin 6	0.0049	0.0387	0.0433
Loa Loa (eye worm)	hypothetical protein	0.0022	0.0061	0.0071
Echinococcus multilocularis	transfer RNA-Lys	0.0043	0.0317	0.0359

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 0.013 uM	Inhibition of solubilized partially purified rat liver HMG-CoA reductase	ChEMBL.	3950902
Relative potency (binding)	= 115	Inhibitory potency against purified rat liver HMG-CoA reductase relative to compactin	ChEMBL.	3950902

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: 179421

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 74243