TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 364.39 | Formula: C19H24O7
H donors: 0 H acceptors: 3 LogP: 0.63 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: CC(=O)OC[C@]12CCC(=CC1OC1C3([C@]2(C)[C@H](OC(=O)C)C1=O)CO3)C
InChi: 1S/C19H24O7/c1-10-5-6-18(8-23-11(2)20)13(7-10)26-16-14(22)15(25-12(3)21)17(18,4)19(16)9-24-19/h7,13,15-16H,5-6,8-9H2,1-4H3/t13?,15-,16?,17-,18-,19?/m1/s1
InChiKey: NHJUGASJCCCIPS-LAJGESLRSA-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
Brugia malayi	AMP-binding enzyme family protein	0.0024	0.0023	0.002
Schistosoma mansoni	hypothetical protein	0.0041	0.0057	0.0207
Echinococcus multilocularis	Zinc carboxypeptidase family protein	0.0029	0.0033	0.0131
Loa Loa (eye worm)	CHromoDomain protein family member	0.0014	0.0003	0.0001
Loa Loa (eye worm)	hypothetical protein	0.0018	0.001	0.0008
Brugia malayi	CHE-14 protein	0.0043	0.006	0.0057
Schistosoma mansoni	family M13 unassigned peptidase (M13 family)	0.0285	0.0543	0.2055
Echinococcus granulosus	chromobox protein 1	0.0068	0.011	0.0465
Trichomonas vaginalis	dihydroorotate dehydrogenase, putative	0.0521	0.1013	1
Loa Loa (eye worm)	hypothetical protein	0.0865	0.1699	0.1697
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0023	0.002
Trichomonas vaginalis	dihydroorotate dehydrogenase, putative	0.0521	0.1013	1
Leishmania major	dihydroorotate dehydrogenase	0.1333	0.2634	1
Entamoeba histolytica	hypothetical protein	0.0111	0.0197	0.1761
Entamoeba histolytica	hypothetical protein	0.0111	0.0197	0.1761
Trichomonas vaginalis	Clan MC, family M14, Zinc carboxypeptidase-like metallopeptidase	0.0029	0.0033	0.0321
Loa Loa (eye worm)	hypothetical protein	0.0018	0.001	0.0008
Schistosoma mansoni	protease m14 carboxypeptidase	0.0029	0.0033	0.0115
Echinococcus multilocularis	TGF beta signal transducer SmadC	0.0025	0.0025	0.0097
Echinococcus granulosus	Zinc carboxypeptidase family protein	0.0029	0.0033	0.0131
Trichomonas vaginalis	conserved hypothetical protein	0.0027	0.0028	0.028
Brugia malayi	MH1 domain containing protein	0.0025	0.0025	0.0022
Mycobacterium ulcerans	long-chain-fatty-acid-CoA ligase	0.0024	0.0023	0.0046
Schistosoma mansoni	hypothetical protein	0.0305	0.0584	0.2209
Echinococcus multilocularis	Niemann Pick C1 protein	0.0142	0.0258	0.1108
Loa Loa (eye worm)	hypothetical protein	0.0885	0.174	0.1738
Schistosoma mansoni	family M13 unassigned peptidase (M13 family)	0.059	0.1152	0.4369
Schistosoma mansoni	hypothetical protein	0.0305	0.0584	0.2209
Loa Loa (eye worm)	zinc metallopeptidase 4	0.0285	0.0543	0.0541
Schistosoma mansoni	TGF-beta signal transducer Smad2	0.0025	0.0025	0.0085
Schistosoma mansoni	family M13 unassigned peptidase (M13 family)	0.0285	0.0543	0.2055
Schistosoma mansoni	chromobox protein	0.0068	0.011	0.0407
Trichomonas vaginalis	chromobox protein, putative	0.0041	0.0056	0.0554
Schistosoma mansoni	family M13 unassigned peptidase (M13 family)	0.117	0.2308	0.8762
Schistosoma mansoni	family M13 unassigned peptidase (M13 family)	0.0285	0.0543	0.2055
Loa Loa (eye worm)	zinc carboxypeptidase	0.0029	0.0033	0.003
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0024	0.0023	0.0046
Echinococcus granulosus	endothelin converting enzyme 1	0.117	0.2308	1
Schistosoma mansoni	tar DNA-binding protein	0.0134	0.0241	0.0907
Schistosoma mansoni	hypothetical protein	0.0041	0.0057	0.0207
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0033	0.003
Brugia malayi	CXXC zinc finger family protein	0.0056	0.0086	0.0083
Schistosoma mansoni	peptidase	0.0029	0.0033	0.0115
Trichomonas vaginalis	dihydroorotate dehydrogenase, putative	0.0521	0.1013	1
Onchocerca volvulus		0.0029	0.0033	0.009
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0024	0.0022	0.0218
Echinococcus granulosus	GPCR family 2	0.0065	0.0105	0.0447
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0207	0.0388	0.0385
Trichomonas vaginalis	conserved hypothetical protein	0.0038	0.005	0.0497
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0065	0.0105	0.0447
Echinococcus multilocularis	dnaJ subfamily B	0.0792	0.1555	0.6735
Loa Loa (eye worm)	TAR-binding protein	0.0134	0.0241	0.0239
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0017	0.0009	0.0029
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0033	0.003
Loa Loa (eye worm)	hypothetical protein	0.0885	0.174	0.1738
Mycobacterium ulcerans	acyl-CoA synthetase	0.0024	0.0023	0.0046
Trichomonas vaginalis	Clan MC, family M14, Zinc carboxypeptidase-like metallopeptidase	0.0029	0.0033	0.0321
Trichomonas vaginalis	Clan MC, family M14, Zinc carboxypeptidase-like metallopeptidase	0.0029	0.0033	0.0321
Trichomonas vaginalis	dihydroorotate dehydrogenase, putative	0.0521	0.1013	1
Schistosoma mansoni	patched 1	0.0043	0.006	0.0218
Schistosoma mansoni	metallocarboxypeptidase D peptidase unit 2 (M14 family)	0.0029	0.0033	0.0115
Echinococcus multilocularis	Niemann Pick C1 protein	0.0099	0.0173	0.0739
Echinococcus granulosus	chromodomain helicase DNA binding protein 4	0.0014	0.0003	0.0004
Schistosoma mansoni	hypothetical protein	0.0029	0.0033	0.0115
Echinococcus multilocularis	GPCR, family 2	0.0065	0.0105	0.0447
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0023	0.002
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0033	0.003
Brugia malayi	Peptidase family M13 containing protein	0.117	0.2308	0.2307
Loa Loa (eye worm)	hypothetical protein	0.0865	0.1699	0.1697
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.0024	0.0022	0.0218
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0024	0.0023	0.0053
Trichomonas vaginalis	Clan MC, family M14, Zinc carboxypeptidase-like metallopeptidase	0.0029	0.0033	0.0321
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0033	0.003
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0207	0.0388	0.0385
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0056	0.0086	0.0083
Echinococcus multilocularis	cytosolic carboxypeptidase protein 5	0.0029	0.0033	0.0131
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.0024	0.0022	0.0218
Trichomonas vaginalis	chromobox protein, putative	0.0068	0.011	0.1081
Echinococcus multilocularis	dihydropyrimidine dehydrogenase (NADP+)	0.0521	0.1013	0.4384
Loa Loa (eye worm)	hypothetical protein	0.0018	0.001	0.0008
Echinococcus multilocularis	Smad4	0.0025	0.0025	0.0097
Loa Loa (eye worm)	hypothetical protein	0.0018	0.001	0.0008
Trichomonas vaginalis	Clan MC, family M14, Zinc carboxypeptidase-like metallopeptidase	0.0029	0.0033	0.0321
Entamoeba histolytica	hypothetical protein	0.0111	0.0197	0.1761
Loa Loa (eye worm)	angiotensin-converting enzyme family protein	0.5026	1	1
Loa Loa (eye worm)	MH2 domain-containing protein	0.0025	0.0025	0.0022
Schistosoma mansoni	dihydroorotate dehydrogenase	0.1333	0.2634	1
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0065	0.0105	0.0103
Onchocerca volvulus		0.058	0.1131	1
Schistosoma mansoni	tar DNA-binding protein	0.0134	0.0241	0.0907
Brugia malayi	MH2 domain containing protein	0.0025	0.0025	0.0022
Leishmania major	zinc carboxypeptidase, putative,metallo-peptidase, Clan MC, Family M14	0.0029	0.0033	0.0038
Schistosoma mansoni	smad	0.0025	0.0025	0.0085
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0017	0.0009	0.0084
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0024	0.0022	0.0218
Brugia malayi	chromobox protein homolog 3	0.0038	0.005	0.0048
Loa Loa (eye worm)	MH1 domain-containing protein	0.0025	0.0025	0.0022
Brugia malayi	TAR-binding protein	0.0134	0.0241	0.0239
Brugia malayi	Zinc finger, C2H2 type family protein	0.0521	0.1013	0.1011
Brugia malayi	latrophilin 2 splice variant baaae	0.0141	0.0257	0.0255
Schistosoma mansoni	hypothetical protein	0.0041	0.0057	0.0207
Trichomonas vaginalis	chromobox protein, putative	0.0068	0.011	0.1081
Trichomonas vaginalis	Clan MC, family M14, Zinc carboxypeptidase-like metallopeptidase	0.0029	0.0033	0.0321
Echinococcus granulosus	smad	0.0025	0.0025	0.0097
Brugia malayi	MH2 domain containing protein	0.0367	0.0708	0.0705
Schistosoma mansoni	endothelin-converting enzyme-related	0.0285	0.0543	0.2055
Schistosoma mansoni	hypothetical protein	0.0065	0.0105	0.0391
Toxoplasma gondii	peptidase family M13 protein	0.117	0.2308	0.8747
Echinococcus multilocularis	subfamily M14A unassigned peptidase	0.0169	0.0311	0.1338
Mycobacterium tuberculosis	Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase)	0.0024	0.0023	0.0053
Leishmania major	zinc carboxypeptidase, putative,metallo-peptidase, Clan MC, Family M14	0.0029	0.0033	0.0038
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0024	0.0022	0.0218
Schistosoma mansoni	family M13 non-peptidase homologue (M13 family)	0.059	0.1152	0.4369
Chlamydia trachomatis	acylglycerophosphoethanolamine acyltransferase	0.0018	0.001	0.5
Brugia malayi	AMP-binding enzyme family protein	0.0024	0.0023	0.002
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0079	0.0077
Loa Loa (eye worm)	hypothetical protein	0.014	0.0253	0.0251
Giardia lamblia	Nuclear ATP/GTP-binding protein	0.0029	0.0033	0.5
Trichomonas vaginalis	dihydropyrimidine dehydrogenase, putative	0.0521	0.1013	1
Onchocerca volvulus	Heterochromatin protein 1 homolog	0.0038	0.005	0.0251
Schistosoma mansoni	hypothetical protein	0.0305	0.0584	0.2209
Echinococcus multilocularis	chromodomain helicase DNA binding protein 4	0.0014	0.0003	0.0004
Loa Loa (eye worm)	hypothetical protein	0.117	0.2308	0.2307
Loa Loa (eye worm)	hypothetical protein	0.0885	0.174	0.1738
Echinococcus granulosus	Protein patched homolog 1	0.0043	0.006	0.0249
Schistosoma mansoni	family M13 unassigned peptidase (M13 family)	0.0305	0.0584	0.2209
Schistosoma mansoni	family M13 non-peptidase homologue (M13 family)	0.0285	0.0543	0.2055
Brugia malayi	Latrophilin receptor protein 2	0.0065	0.0105	0.0103
Mycobacterium leprae	Probable dihydroorotate dehydrogenase PyrD	0.1333	0.2634	1
Loa Loa (eye worm)	hypothetical protein	0.003	0.0034	0.0032
Loa Loa (eye worm)	RNA binding protein	0.0134	0.0241	0.0239
Loa Loa (eye worm)	transcription factor SMAD2	0.0367	0.0708	0.0705
Schistosoma mansoni	peptidase	0.0029	0.0033	0.0115
Loa Loa (eye worm)	hypothetical protein	0.0885	0.174	0.1738
Echinococcus multilocularis		0.0029	0.0033	0.0131
Toxoplasma gondii	dihydroorotate dehydrogenase reveal, putative	0.1333	0.2634	1
Onchocerca volvulus		0.0169	0.0311	0.2603
Loa Loa (eye worm)	hypothetical protein	0.0885	0.174	0.1738
Mycobacterium tuberculosis	Probable dihydroorotate dehydrogenase PyrD	0.1333	0.2634	1
Brugia malayi	Zinc carboxypeptidase family protein	0.0029	0.0033	0.003
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.0018	0.001	0.0103
Giardia lamblia	Nuclear ATP/GTP-binding protein	0.0029	0.0033	0.5
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0024	0.0022	0.0218
Trichomonas vaginalis	dihydroorotate dehydrogenase, putative	0.0521	0.1013	1
Schistosoma mansoni	hypothetical protein	0.0041	0.0057	0.0207
Brugia malayi	peptidase family M13 containing protein	0.0285	0.0543	0.0541
Echinococcus granulosus	sterol regulatory element binding protein	0.0043	0.006	0.0249
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0024	0.0022	0.0218
Brugia malayi	hypothetical protein	0.0111	0.0197	0.0195
Loa Loa (eye worm)	hypothetical protein	0.0865	0.1699	0.1697
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0017	0.0009	0.0029
Loa Loa (eye worm)	zinc carboxypeptidase	0.0029	0.0033	0.003
Mycobacterium ulcerans	acyl-CoA synthetase	0.0024	0.0023	0.0046
Schistosoma mansoni	hypothetical protein	0.0792	0.1555	0.5901
Onchocerca volvulus		0.0169	0.0311	0.2603
Echinococcus multilocularis	chromobox protein 1	0.0068	0.011	0.0465
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0033	0.003
Schistosoma mansoni	smad1 5 8 and	0.0025	0.0025	0.0085
Mycobacterium ulcerans	hypothetical protein	0.0024	0.0023	0.0046
Trichomonas vaginalis	conserved hypothetical protein	0.0027	0.0028	0.028
Echinococcus multilocularis	cpg binding protein	0.0059	0.0092	0.0389
Mycobacterium ulcerans	dihydroorotate dehydrogenase 2	0.1333	0.2634	1
Loa Loa (eye worm)	Smad1	0.0025	0.0025	0.0022
Echinococcus multilocularis	mothers against decapentaplegic 5	0.0025	0.0025	0.0097
Schistosoma mansoni	chromobox protein	0.0068	0.011	0.0407
Schistosoma mansoni	peptidase	0.0029	0.0033	0.0115
Echinococcus granulosus	Niemann Pick C1 protein	0.0142	0.0258	0.1108
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0065	0.0105	0.0447
Loa Loa (eye worm)	hypothetical protein	0.0885	0.174	0.1738
Trichomonas vaginalis	Clan MC, family M14, Zinc carboxypeptidase-like metallopeptidase	0.0029	0.0033	0.0321
Mycobacterium ulcerans	acyl-CoA synthetase	0.0024	0.0023	0.0046
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0033	0.003
Echinococcus granulosus	mothers against decapentaplegic 5	0.0025	0.0025	0.0097
Onchocerca volvulus	Heterochromatin protein 1 homolog	0.0041	0.0056	0.0303
Brugia malayi	F/Y-rich N-terminus family protein	0.0017	0.0009	0.0006
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0065	0.0105	0.0447
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0033	0.003
Trichomonas vaginalis	Clan MC, family M14, Zinc carboxypeptidase-like metallopeptidase	0.0029	0.0033	0.0321
Loa Loa (eye worm)	hypothetical protein	0.0207	0.0388	0.0385
Loa Loa (eye worm)	hypothetical protein	0.0018	0.001	0.0008
Brugia malayi	Zinc carboxypeptidase family protein	0.0029	0.0033	0.003
Echinococcus granulosus	Smad4	0.0025	0.0025	0.0097
Schistosoma mansoni	Nep2 peptidase (M13 family)	0.059	0.1152	0.4369
Trichomonas vaginalis	conserved hypothetical protein	0.0043	0.006	0.0591
Wolbachia endosymbiont of Brugia malayi	dihydroorotate dehydrogenase 2	0.1333	0.2634	0.5
Schistosoma mansoni	carboxypeptidase N (M14 family)	0.0029	0.0033	0.0115
Echinococcus multilocularis	sterol regulatory element binding protein	0.0043	0.006	0.0249
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0118	0.021	0.079
Giardia lamblia	Nuclear ATP/GTP-binding protein	0.0029	0.0033	0.5
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0033	0.003
Echinococcus multilocularis	smad	0.0025	0.0025	0.0097
Brugia malayi	CHD4 protein	0.0014	0.0003	0.0001
Trypanosoma cruzi	dihydroorotate dehydrogenase (fumarate), putative	0.1333	0.2634	1
Mycobacterium tuberculosis	Probable zinc metalloprotease Zmp1	0.117	0.2308	0.8759
Trichomonas vaginalis	conserved hypothetical protein	0.0038	0.005	0.0497
Schistosoma mansoni	hypothetical protein	0.0305	0.0584	0.2209
Brugia malayi	Zinc carboxypeptidase family protein	0.0029	0.0033	0.003
Schistosoma mansoni	tar DNA-binding protein	0.0134	0.0241	0.0907
Schistosoma mansoni	cpg binding protein	0.0059	0.0092	0.0341
Onchocerca volvulus		0.003	0.0034	0.0104
Echinococcus granulosus	Niemann Pick C1 protein	0.0099	0.0173	0.0739
Brugia malayi	RNA binding protein	0.0134	0.0241	0.0239
Schistosoma mansoni	transcription factor LCR-F1	0.0111	0.0197	0.074
Schistosoma mansoni	hypothetical protein	0.0065	0.0105	0.0391
Brugia malayi	AMP-binding enzyme family protein	0.0024	0.0023	0.002
Loa Loa (eye worm)	histone methyltransferase	0.0017	0.0009	0.0007
Echinococcus granulosus	cpg binding protein	0.0059	0.0092	0.0389
Echinococcus granulosus	dihydropyrimidine dehydrogenase NADP	0.0521	0.1013	0.4384
Leishmania major	zinc carboxypeptidase, putative,metallo-peptidase, Clan MC, Family M14	0.0029	0.0033	0.0038
Brugia malayi	Heterochromatin protein 1	0.0068	0.011	0.0107
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0033	0.003
Loa Loa (eye worm)	zinc carboxypeptidase	0.0029	0.0033	0.003
Echinococcus granulosus	chromobox protein 1	0.0068	0.011	0.0465
Brugia malayi	Carboxypeptidase A2 precursor	0.0029	0.0033	0.003
Loa Loa (eye worm)	hypothetical protein	0.0141	0.0257	0.0255
Echinococcus multilocularis	tar DNA binding protein	0.0134	0.0241	0.1036
Onchocerca volvulus	Subfamily M14A unassigned peptidase homolog	0.0169	0.0311	0.2603
Plasmodium falciparum	dihydroorotate dehydrogenase	0.1333	0.2634	1
Loa Loa (eye worm)	abnormal chemotaxis protein 14	0.0043	0.006	0.0057
Mycobacterium leprae	probable zinc metalloprotease	0.117	0.2308	0.8752
Schistosoma mansoni	smad1 5 8 and	0.0025	0.0025	0.0085
Plasmodium vivax	dihydroorotate dehydrogenase, mitochondrial precursor, putative	0.1333	0.2634	1
Brugia malayi	Zinc carboxypeptidase family protein	0.0029	0.0033	0.003
Mycobacterium ulcerans	zinc metalloprotease	0.117	0.2308	0.8758
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0065	0.0105	0.0103
Brugia malayi	Zinc carboxypeptidase family protein	0.0029	0.0033	0.003
Loa Loa (eye worm)	zinc carboxypeptidase	0.0029	0.0033	0.003
Brugia malayi	Zinc carboxypeptidase family protein	0.0029	0.0033	0.003
Trichomonas vaginalis	conserved hypothetical protein	0.0018	0.001	0.0103
Echinococcus granulosus	dihydropyrimidine dehydrogenase NADP	0.0521	0.1013	0.4384
Brugia malayi	RNA recognition motif domain containing protein	0.0134	0.0241	0.0239
Onchocerca volvulus		0.0169	0.0311	0.2603
Schistosoma mansoni	Smad4	0.0025	0.0025	0.0085
Trypanosoma brucei	dihydroorotate dehydrogenase (fumarate)	0.1333	0.2634	1
Brugia malayi	Dihydroorotate dehydrogenase, mitochondrial precursor, putative	0.1333	0.2634	0.2633
Loa Loa (eye worm)	hypothetical protein	0.0099	0.0173	0.0171
Entamoeba histolytica	dihydropyrimidine dehydrogenase, putative	0.0521	0.1013	1
Brugia malayi	Niemann-Pick C1 protein precursor	0.0099	0.0173	0.0171
Entamoeba histolytica	hypothetical protein	0.0111	0.0197	0.1761
Trypanosoma cruzi	dihydroorotate dehydrogenase, putative	0.1333	0.2634	1
Schistosoma mansoni	family M14 non-peptidase homologue (M14 family)	0.0029	0.0033	0.0115
Echinococcus granulosus	subfamily M14A unassigned peptidase	0.0169	0.0311	0.1338
Schistosoma mansoni	hypothetical protein	0.0141	0.0257	0.0967
Loa Loa (eye worm)	hypothetical protein	0.0043	0.006	0.0057
Brugia malayi	MH1 domain containing protein	0.0025	0.0025	0.0022
Echinococcus granulosus	TGF beta signal transducer SmadC	0.0025	0.0025	0.0097
Brugia malayi	Zinc carboxypeptidase family protein	0.0029	0.0033	0.003
Mycobacterium ulcerans	long-chain fatty-acid CoA ligase	0.0024	0.0023	0.0046
Loa Loa (eye worm)	heterochromatin protein 1	0.0068	0.011	0.0107
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0033	0.003
Mycobacterium ulcerans	long-chain-fatty-acid--CoA ligase	0.0024	0.0023	0.0046
Brugia malayi	Hypothetical zinc metalloproteinase T16A9.4	0.117	0.2308	0.2307
Trypanosoma cruzi	dihydroorotate dehydrogenase, putative	0.0521	0.1013	0.377
Schistosoma mansoni	neprilysin-2 (M13 family)	0.059	0.1152	0.4369
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0207	0.0388	0.0385
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0111	0.0197	0.0844
Echinococcus granulosus	dnaJ subfamily B	0.0792	0.1555	0.6735
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0134	0.0241	0.0239
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0105	0.0185	0.0586
Loa Loa (eye worm)	hypothetical protein	0.058	0.1131	0.1129
Schistosoma mansoni	cpg binding protein	0.0056	0.0086	0.0317
Schistosoma mansoni	neprilysin	0.0305	0.0584	0.2209
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0024	0.0022	0.0218
Plasmodium vivax	hypothetical protein, conserved	0.0029	0.0033	0.0084
Schistosoma mansoni	hypothetical protein	0.0065	0.0105	0.0391
Onchocerca volvulus		0.0029	0.0033	0.009
Brugia malayi	Dihydroorotate dehydrogenase, mitochondrial precursor, putative	0.1333	0.2634	0.2633
Loa Loa (eye worm)	peptidase family M13 containing protein	0.0865	0.1699	0.1697
Echinococcus multilocularis	expressed conserved protein	0.0093	0.0161	0.0687
Loa Loa (eye worm)	MH2 domain-containing protein	0.0367	0.0708	0.0705
Schistosoma mansoni	chromodomain helicase DNA binding protein	0.0014	0.0003	0.0003
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0065	0.0105	0.0447
Loa Loa (eye worm)	hypothetical protein	0.0865	0.1699	0.1697
Mycobacterium tuberculosis	Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.0018	0.001	0.0007
Schistosoma mansoni	niemann-pick C1 (NPC1)	0.0101	0.0176	0.066
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0023	0.002
Schistosoma mansoni	cpg binding protein	0.0059	0.0092	0.0341
Schistosoma mansoni	hypothetical protein	0.0305	0.0584	0.2209
Trypanosoma cruzi	dihydroorotate dehydrogenase, putative	0.1333	0.2634	1
Trichomonas vaginalis	Clan MC, family M14, Zinc carboxypeptidase-like metallopeptidase	0.0029	0.0033	0.0321
Onchocerca volvulus	Carboxypeptidase D homolog	0.0029	0.0033	0.009
Schistosoma mansoni	hypothetical protein	0.0065	0.0105	0.0391
Trichomonas vaginalis	chromobox protein, putative	0.0041	0.0056	0.0554
Echinococcus multilocularis	endothelin converting enzyme 1	0.117	0.2308	1
Brugia malayi	Smad1	0.0025	0.0025	0.0022
Schistosoma mansoni	smad1 5 8 and	0.0025	0.0025	0.0085
Loa Loa (eye worm)	hypothetical protein	0.117	0.2308	0.2307
Echinococcus multilocularis	protein patched	0.0043	0.006	0.0249
Schistosoma mansoni	hypothetical protein	0.0111	0.0197	0.074
Schistosoma mansoni	hypothetical protein	0.0305	0.0584	0.2209
Loa Loa (eye worm)	peptidase family M13 containing protein	0.0865	0.1699	0.1697
Entamoeba histolytica	Niemann-Pick C1 protein, putative	0.0099	0.0173	0.1518
Echinococcus multilocularis	dihydropyrimidine dehydrogenase (NADP+)	0.0521	0.1013	0.4384
Brugia malayi	Zinc carboxypeptidase family protein	0.0029	0.0033	0.003
Loa Loa (eye worm)	hypothetical protein	0.0065	0.0105	0.0103
Brugia malayi	MH2 domain containing protein	0.0025	0.0025	0.0022
Onchocerca volvulus		0.0056	0.0086	0.0571
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0111	0.0197	0.0844
Echinococcus granulosus	tar DNA binding protein	0.0134	0.0241	0.1036
Loa Loa (eye worm)	hypothetical protein	0.117	0.2308	0.2307
Schistosoma mansoni	endothelin-converting enzyme-like 1 (damage-induced neuronal endopeptidase)	0.0285	0.0543	0.2055
Echinococcus multilocularis	chromobox protein 1	0.0068	0.011	0.0465
Schistosoma mansoni	family M13 unassigned peptidase (M13 family)	0.059	0.1152	0.4369
Echinococcus multilocularis	protein dispatched 1	0.0049	0.0072	0.0301
Echinococcus granulosus	cytosolic carboxypeptidase protein 5	0.0029	0.0033	0.0131
Loa Loa (eye worm)	hypothetical protein	0.0038	0.005	0.0048
Onchocerca volvulus	Cytosolic carboxypeptidase 1 homolog	0.0029	0.0033	0.009
Trichomonas vaginalis	Clan MC, family M14, Zinc carboxypeptidase-like metallopeptidase	0.0029	0.0033	0.0321
Onchocerca volvulus		0.0169	0.0311	0.2603
Schistosoma mansoni	tar DNA-binding protein	0.0134	0.0241	0.0907
Schistosoma mansoni	tar DNA-binding protein	0.0134	0.0241	0.0907
Echinococcus granulosus	expressed conserved protein	0.0093	0.0161	0.0687
Schistosoma mansoni	subfamily M14A unassigned peptidase (M14 family)	0.0169	0.0311	0.1173
Echinococcus granulosus	cytosolic carboxypeptidase 1	0.0029	0.0033	0.0131
Trichomonas vaginalis	Clan MC, family M14, Zinc carboxypeptidase-like metallopeptidase	0.0029	0.0033	0.0321

Activities

Activity type	Activity value	Assay description	Source	Reference
Activity index (functional)	= 1.02	Ratio of the maximum T/C of the analogue and the maximum T/C of the anguidin test at dose 2.0 mg/kg	ChEMBL.	7086845
Activity index (functional)	= 1.09	Ratio of the maximum T/C of the analogue and the maximum T/C of the anguidin test at dose 0.8 mg/kg	ChEMBL.	7086845
Activity index (functional)	= 1.42	Ratio of the maximum T/C of the analogue and the maximum T/C of the anguidin test at dose 0.8 mg/kg	ChEMBL.	7086845
Activity index (functional)	= 1.42	Activity index of the compound was reported against P-388 leukemia	ChEMBL.	7086845
Activity of control (functional)	= 26 %	Incorporatito of L-[4,5-3H] leucine into intact H-Hela cells was examined at ctocentratito 3.0 microg/mL at 8 min after introductito of the drug.	ChEMBL.	7086845
Activity of control (functional)	= 26 %	Incorporatito of L-[4,5-3H] leucine into intact H-Hela cells was examined at ctocentratito 3.0 microg/mL at 8 min after introductito of the drug.	ChEMBL.	7086845
Activity of control (functional)	= 46 %	Incorporatito of L-[4,5-3H] leucine into intact H-Hela cells was examined at ctocentratito 1.0 microg/mL at 8 min after introductito of the drug.	ChEMBL.	7086845
Activity of control (functional)	= 46 %	Incorporatito of L-[4,5-3H] leucine into intact H-Hela cells was examined at ctocentratito 1.0 microg/mL at 8 min after introductito of the drug.	ChEMBL.	7086845
Activity of control (functional)	= 84 %	Incorporatito of L-[4,5-3H] leucine into intact H-Hela cells was examined at ctocentratito 0.3 microg/mL at 8 min after introductito of the drug.	ChEMBL.	7086845
Activity of control (functional)	= 84 %	Incorporatito of L-[4,5-3H] leucine into intact H-Hela cells was examined at ctocentratito 0.3 microg/mL at 8 min after introductito of the drug.	ChEMBL.	7086845
Activity of control (functional)	= 94 %	Incorporatito of L-[4,5-3H] leucine into intact H-Hela cells was examined at ctocentratito 0.1 microg/mL at 8 min after introductito of the drug.	ChEMBL.	7086845
Activity of control (functional)	= 94 %	Incorporatito of L-[4,5-3H] leucine into intact H-Hela cells was examined at ctocentratito 0.1 microg/mL at 8 min after introductito of the drug.	ChEMBL.	7086845
MED (functional)	= 0.0125 mg kg-1	Minimum effective dose required for inhibitory activity against P-388 leukemia	ChEMBL.	7086845
MED (functional)	= 0.0125 mg kg-1	Minimum effective dose required for inhibitory activity against P-388 leukemia	ChEMBL.	7086845
No. of survivors (functional)	= 133 %	Mice with B16 melanoma surviving on day 60 post implant at dose 2.0 mg/kg	ChEMBL.	7086845
No. of survivors (functional)	= 133 %	Mice with B16 melanoma surviving on day 60 post implant at dose 2.0 mg/kg	ChEMBL.	7086845
T/C (functional)	= 200 %	Mice with L1210 tumor surviving on day 60 post implant at dose 0.8 mg/kg	ChEMBL.	7086845
T/C (functional)	= 200 %	Mice with L1210 tumor surviving on day 60 post implant at dose 0.8 mg/kg	ChEMBL.	7086845
T/C (functional)	= 222 %	Mice with P-388 leukemia surviving on day 30 post implant at dose 0.8 mg/kg	ChEMBL.	7086845
T/C (functional)	= 222 %	Mice with P-388 leukemia surviving on day 30 post implant at dose 0.8 mg/kg	ChEMBL.	7086845

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: CHEMBL345829

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 266851