TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 531.492 | Formula: C19H19F6N3O4S2
H donors: 2 H acceptors: 5 LogP: 3.47 Rotable bonds: 8
Rule of 5 violations (Lipinski): 2
SMILES: O=C(C1(CCN(CC1)c1ncc(s1)C(C(F)(F)F)(C(F)(F)F)O)c1ccccc1)NS(=O)(=O)C
InChi: 1S/C19H19F6N3O4S2/c1-34(31,32)27-14(29)16(12-5-3-2-4-6-12)7-9-28(10-8-16)15-26-11-13(33-15)17(30,18(20,21)22)19(23,24)25/h2-6,11,30H,7-10H2,1H3,(H,27,29)
InChiKey: PISWOFOEBOEMFE-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
Mus musculus	malonyl-CoA decarboxylase	Starlite/ChEMBL	References
Homo sapiens	malonyl-CoA decarboxylase	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Leishmania braziliensis	malonyl-coa decarboxylase-like protein	Get druggable targets OG5_131397	All targets in OG5_131397
Leishmania mexicana	malonyl-coa decarboxylase-like protein	Get druggable targets OG5_131397	All targets in OG5_131397
Trypanosoma cruzi	malonyl-CoA decarboxylase, mitochondrial precursor, putative	Get druggable targets OG5_131397	All targets in OG5_131397
Trypanosoma brucei gambiense	malonyl-CoA decarboxylase, mitochondrial precursor, putative	Get druggable targets OG5_131397	All targets in OG5_131397
Brugia malayi	putative malonyl-CoA decarboxylase	Get druggable targets OG5_131397	All targets in OG5_131397
Leishmania major	malonyl-coa decarboxylase-like protein	Get druggable targets OG5_131397	All targets in OG5_131397
Trypanosoma cruzi	malonyl-CoA decarboxylase, mitochondrial precursor, putative	Get druggable targets OG5_131397	All targets in OG5_131397
Trypanosoma congolense	malonyl-CoA decarboxylase, mitochondrial precursor, putative	Get druggable targets OG5_131397	All targets in OG5_131397
Trypanosoma brucei	malonyl-CoA decarboxylase, mitochondrial precursor, putative	Get druggable targets OG5_131397	All targets in OG5_131397
Leishmania infantum	malonyl-coa decarboxylase-like protein	Get druggable targets OG5_131397	All targets in OG5_131397
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_131397	All targets in OG5_131397
Wolbachia endosymbiont of Brugia malayi	malonyl-CoA decarboxylase	Get druggable targets OG5_131397	All targets in OG5_131397
Leishmania donovani	malonyl-coa decarboxylase-like protein	Get druggable targets OG5_131397	All targets in OG5_131397

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
Echinococcus multilocularis	thyroid hormone receptor alpha	0.002	0.0071	0.0071
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.002	0.0071	0.0071
Loa Loa (eye worm)	hypothetical protein	0.002	0.0071	0.0041
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0102	0.0077
Schistosoma mansoni	hypothetical protein	0.0514	0.4039	0.4039
Schistosoma mansoni	retinoic acid receptor RXR	0.002	0.0071	0.0071
Mycobacterium ulcerans	acyl-CoA synthetase	0.0024	0.0102	1
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0027	0.0127	0.0127
Leishmania major	4-coumarate:coa ligase-like protein	0.0024	0.0102	0.0212
Brugia malayi	Smad1	0.0017	0.0042	0.0006
Mycobacterium ulcerans	hypothetical protein	0.0024	0.0102	1
Loa Loa (eye worm)	hypothetical protein	0.002	0.0071	0.0041
Leishmania major	4-coumarate:coa ligase-like protein	0.0024	0.0102	0.0212
Schistosoma mansoni	DNA polymerase eta	0.002	0.0067	0.0067
Loa Loa (eye worm)	histone methyltransferase	0.0027	0.0127	0.0107
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.002	0.0071	0.0071
Schistosoma mansoni	TGF-beta signal transducer Smad2	0.0017	0.0042	0.0042
Loa Loa (eye worm)	hypothetical protein	0.002	0.0067	0.0036
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0022	0.0083	0.0083
Trypanosoma cruzi	malonyl-CoA decarboxylase, mitochondrial precursor, putative	0.0396	0.3092	1
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.002	0.0071	0.0071
Echinococcus granulosus	dna polymerase kappa	0.002	0.0067	0.0067
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.002	0.0071	0.0071
Trichomonas vaginalis	conserved hypothetical protein	0.002	0.0068	1
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0047	0.0282	0.0282
Echinococcus granulosus	FTZ F1 alpha	0.002	0.0071	0.0071
Trypanosoma brucei	malonyl-CoA decarboxylase, mitochondrial precursor, putative	0.0396	0.3092	1
Echinococcus granulosus	dna polymerase eta	0.002	0.0067	0.0067
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.002	0.0071	0.0041
Schistosoma mansoni	NADP-specific isocitrate dehydrogenase	0.0016	0.0037	0.0037
Mycobacterium ulcerans	long-chain-fatty-acid-CoA ligase	0.0024	0.0102	1
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0114	0.0092
Echinococcus granulosus	GPCR family 2	0.0047	0.0287	0.0287
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0187	0.1411	0.1411
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0053	0.0019
Loa Loa (eye worm)	hypothetical protein	0.0149	0.1108	0.1276
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0016	0.0037	0.0037
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.0067	0.0162
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.002	0.0071	0.0071
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.0067	0.0162
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.002	0.0071	0.0041
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0047	0.0282	0.0292
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.002	0.0071	0.0071
Schistosoma mansoni	inositol transporter	0.0117	0.0848	0.0848
Echinococcus multilocularis	terminal deoxycytidyl transferase rev1	0.002	0.0067	0.0067
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.002	0.0071	0.0071
Schistosoma mansoni	hypothetical protein	0.0047	0.0287	0.0287
Echinococcus multilocularis	ecdysone induced protein 78C	0.002	0.0071	0.0071
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.002	0.0071	0.0041
Schistosoma mansoni	RAR-like nuclear receptor	0.002	0.0071	0.0071
Brugia malayi	steroid hormone receptor	0.002	0.0071	0.0041
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0017	0.0045	0.1199
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0167	0.125	1
Entamoeba histolytica	hypothetical protein	0.0037	0.0208	1
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.002	0.0071	0.0071
Echinococcus granulosus	sodium:glucose cotransporter 2	0.0117	0.0848	0.0848
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0047	0.0282	0.0282
Brugia malayi	hypothetical protein	0.0017	0.0041	0.0004
Loa Loa (eye worm)	transcription factor SMAD2	0.0246	0.1882	0.2197
Echinococcus multilocularis	dna polymerase eta	0.002	0.0067	0.0067
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0024	0.0102	0.5
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0024	0.0102	1
Brugia malayi	AMP-binding enzyme family protein	0.0024	0.0102	0.0077
Schistosoma mansoni	hypothetical protein	0.0514	0.4039	0.4039
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0088	0.0616	0.069
Echinococcus granulosus	TGF beta signal transducer SmadC	0.0017	0.0042	0.0042
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.002	0.0071	0.0041
Brugia malayi	GH02984p	0.106	0.8433	1
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.002	0.0068	1
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0047	0.0282	0.0282
Loa Loa (eye worm)	Smad1	0.0017	0.0042	0.0006
Trichomonas vaginalis	conserved hypothetical protein	0.002	0.0068	1
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0037	0.0208	0.0208
Loa Loa (eye worm)	hypothetical protein	0.1008	0.8012	0.9499
Echinococcus granulosus	cpg binding protein	0.0093	0.0656	0.0656
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0047	0.0287	0.0287
Brugia malayi	MH1 domain containing protein	0.0017	0.0042	0.0006
Plasmodium falciparum	ataxin-2 like protein, putative	0.0026	0.0114	1
Onchocerca volvulus		0.015	0.1116	1
Schistosoma mansoni	hypothetical protein	0.0047	0.0287	0.0287
Schistosoma mansoni	rab geranylgeranyl transferase alpha subunit	0.002	0.0067	0.0067
Leishmania major	DNA polymerase kappa, putative,DNA polymerase IV, putative	0.002	0.0067	0.01
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0017	0.0045	0.1199
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.002	0.0068	1
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0149	0.1108	0.1276
Brugia malayi	putative malonyl-CoA decarboxylase	0.1008	0.8012	0.9499
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0013	0.0009	0.0009
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.002	0.0071	0.0071
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.0067	0.0162
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.002	0.0071	0.0041
Leishmania major	hypothetical protein, conserved	0.0026	0.0114	0.0252
Loa Loa (eye worm)	MH2 domain-containing protein	0.0246	0.1882	0.2197
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0047	0.0282	0.0282
Trichomonas vaginalis	conserved hypothetical protein	0.002	0.0068	1
Echinococcus multilocularis	sodium:myo inositol cotransporter	0.0117	0.0848	0.0848
Schistosoma mansoni	coup transcription factor	0.002	0.0071	0.0071
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0047	0.0287	0.0287
Echinococcus multilocularis	cpg binding protein	0.0093	0.0656	0.0656
Mycobacterium ulcerans	acyl-CoA synthetase	0.0024	0.0102	1
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.002	0.0071	0.0071
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.002	0.0071	0.0041
Schistosoma mansoni	terminal deoxycytidyl transferase	0.002	0.0067	0.0067
Brugia malayi	Nuclear hormone receptor-like 1	0.002	0.0071	0.0041
Mycobacterium tuberculosis	Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.0018	0.0053	0.2422
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.002	0.0071	0.0041
Loa Loa (eye worm)	hypothetical protein	0.106	0.8433	1
Echinococcus granulosus	terminal deoxycytidyl transferase rev1	0.002	0.0067	0.0067
Schistosoma mansoni	transcription factor LCR-F1	0.0037	0.0208	0.0208
Mycobacterium tuberculosis	Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed))	0.002	0.0067	0.4715
Echinococcus multilocularis	Smad4	0.0017	0.0042	0.0042
Echinococcus multilocularis	sodium coupled monocarboxylate transporter 1	0.0117	0.0848	0.0848
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0149	0.1108	0.1276
Mycobacterium ulcerans	long-chain fatty-acid CoA ligase	0.0024	0.0102	1
Loa Loa (eye worm)	hypothetical protein	0.015	0.1116	0.1286
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.002	0.0068	1
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0053	0.0019
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0047	0.0282	0.0292
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0047	0.0287	0.0298
Entamoeba histolytica	hypothetical protein	0.0037	0.0208	1
Brugia malayi	F/Y-rich N-terminus family protein	0.0027	0.0124	0.0104
Schistosoma mansoni	hypothetical protein	0.1255	1	1
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0017	0.0045	0.1199
Trypanosoma cruzi	DNA polymerase eta, putative	0.002	0.0067	0.01
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.002	0.0071	0.0071
Mycobacterium ulcerans	acyl-CoA synthetase	0.0024	0.0102	1
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0053	0.0019
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.002	0.0071	0.0041
Brugia malayi	AMP-binding enzyme family protein	0.0024	0.0102	0.0077
Echinococcus multilocularis	dna polymerase kappa	0.002	0.0067	0.0067
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0102	0.0077
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.0067	0.0162
Echinococcus multilocularis	geminin	0.0514	0.4039	0.4039
Entamoeba histolytica	acyl-coA synthetase, putative	0.0024	0.0102	0.244
Schistosoma mansoni	hypothetical protein	0.0037	0.0208	0.0208
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.002	0.0071	0.0041
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0047	0.0282	0.0282
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.002	0.0068	1
Wolbachia endosymbiont of Brugia malayi	malonyl-CoA decarboxylase	0.1008	0.8012	0.5
Trichomonas vaginalis	helicase, putative	0.002	0.0068	1
Echinococcus granulosus	NADP dependent isocitrate dehydrogenase	0.0016	0.0037	0.0037
Schistosoma mansoni	smad1 5 8 and	0.0017	0.0042	0.0042
Schistosoma mansoni	sodium/solute symporter	0.0117	0.0848	0.0848
Schistosoma mansoni	inositol transporter	0.0117	0.0848	0.0848
Trypanosoma cruzi	DNA polymerase kappa, putative	0.002	0.0067	0.01
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.002	0.0071	0.0071
Echinococcus granulosus	high affinity choline transporter 1	0.106	0.8433	0.8433
Trichomonas vaginalis	conserved hypothetical protein	0.002	0.0068	1
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.002	0.0071	0.0041
Loa Loa (eye worm)	MH2 domain-containing protein	0.0017	0.0042	0.0006
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0149	0.1108	0.1276
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0047	0.0287	0.0298
Onchocerca volvulus		0.0088	0.0616	0.5214
Echinococcus granulosus	geminin	0.0514	0.4039	0.4039
Brugia malayi	photoreceptor-specific nuclear receptor	0.002	0.0071	0.0041
Brugia malayi	MH2 domain containing protein	0.0246	0.1882	0.2197
Entamoeba histolytica	hypothetical protein	0.0037	0.0208	1
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.002	0.0071	0.0071
Trypanosoma cruzi	DNA polymerase kappa, putative	0.002	0.0067	0.01
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.002	0.0068	1
Trypanosoma brucei	PAB1-binding protein , putative	0.0026	0.0114	0.0312
Trypanosoma cruzi	DNA polymerase kappa, putative	0.002	0.0067	0.01
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0016	0.0037	0.0037
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.002	0.0068	1
Brugia malayi	MH1 domain containing protein	0.0017	0.0042	0.0006
Schistosoma mansoni	smad	0.0017	0.0042	0.0042
Brugia malayi	ecdysteroid receptor	0.002	0.0071	0.0041
Brugia malayi	AMP-binding enzyme family protein	0.0024	0.0102	0.0077
Loa Loa (eye worm)	hypothetical protein	0.0102	0.0728	0.0823
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.002	0.0071	0.0041
Mycobacterium ulcerans	DNA polymerase IV	0.002	0.0067	0.3025
Trypanosoma cruzi	PAB1-binding protein , putative	0.0026	0.0114	0.0252
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.002	0.0071	0.0041
Brugia malayi	MH2 domain containing protein	0.0017	0.0042	0.0006
Schistosoma mansoni	thyroid hormone receptor	0.002	0.0071	0.0071
Schistosoma mansoni	cpg binding protein	0.0088	0.0616	0.0616
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0037	0.0208	0.0208
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.002	0.0068	1
Toxoplasma gondii	transporter, solute:sodium symporter (SSS) family protein	0.0117	0.0848	0.6684
Schistosoma mansoni	cpg binding protein	0.0093	0.0656	0.0656
Trypanosoma brucei	isocitrate dehydrogenase, putative	0.0016	0.0037	0.0062
Brugia malayi	latrophilin 2 splice variant baaae	0.0102	0.0728	0.0823
Plasmodium vivax	acyl-CoA synthetase, putative	0.0018	0.0053	0.2042
Echinococcus granulosus	Smad4	0.0017	0.0042	0.0042
Echinococcus multilocularis	mixed lineage leukemia protein mll	0.0022	0.0083	0.0083
Trypanosoma cruzi	malonyl-CoA decarboxylase, mitochondrial precursor, putative	0.0396	0.3092	1
Chlamydia trachomatis	acylglycerophosphoethanolamine acyltransferase	0.0018	0.0053	0.5
Trichomonas vaginalis	conserved hypothetical protein	0.002	0.0068	1
Echinococcus granulosus	solute carrier family 5	0.0117	0.0848	0.0848
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0047	0.0282	0.0282
Echinococcus multilocularis	solute carrier family 5	0.0117	0.0848	0.0848
Brugia malayi	Steroid receptor seven-up type 2	0.002	0.0071	0.0041
Echinococcus granulosus	ecdysone induced protein 78C	0.002	0.0071	0.0071
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.002	0.0071	0.0071
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.002	0.0071	0.0071
Brugia malayi	MH2 domain containing protein	0.0017	0.0042	0.0006
Entamoeba histolytica	hypothetical protein	0.0037	0.0208	1
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0027	0.0127	0.0127
Brugia malayi	hypothetical protein	0.0037	0.0208	0.0204
Onchocerca volvulus		0.0024	0.0102	0.0294
Loa Loa (eye worm)	hypothetical protein	0.002	0.0071	0.0041
Brugia malayi	hypothetical protein	0.0026	0.0114	0.0092
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.002	0.0071	0.0041
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0047	0.0282	0.0282
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.002	0.0071	0.0041
Trypanosoma brucei	unspecified product	0.002	0.0067	0.0162
Mycobacterium ulcerans	long-chain-fatty-acid--CoA ligase	0.0024	0.0102	1
Brugia malayi	CXXC zinc finger family protein	0.0088	0.0616	0.069
Schistosoma mansoni	hypothetical protein	0.0047	0.0287	0.0287
Leishmania major	malonyl-coa decarboxylase-like protein	0.0396	0.3092	1
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0024	0.0102	1
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0024	0.0102	0.244
Trypanosoma brucei	DNA polymerase eta, putative	0.002	0.0067	0.0162
Echinococcus multilocularis	TGF beta signal transducer SmadC	0.0017	0.0042	0.0042
Brugia malayi	hypothetical protein	0.015	0.1116	0.1286
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0022	0.0083	0.0083
Loa Loa (eye worm)	MH1 domain-containing protein	0.0017	0.0042	0.0006
Echinococcus multilocularis	FTZ F1 alpha	0.002	0.0071	0.0071
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0024	0.0102	0.5
Leishmania major	DNA polymerase kappa, putative	0.002	0.0067	0.01
Loa Loa (eye worm)	hypothetical protein	0.0117	0.0848	0.0966
Brugia malayi	nuclear hormone receptor	0.002	0.0071	0.0041
Brugia malayi	Latrophilin receptor protein 2	0.0047	0.0287	0.0298
Plasmodium falciparum	acyl-CoA synthetase	0.0018	0.0053	0.2042
Trichomonas vaginalis	conserved hypothetical protein	0.002	0.0068	1
Mycobacterium ulcerans	DNA polymerase IV	0.002	0.0067	0.3025
Echinococcus granulosus	sodium:myo inositol cotransporter	0.0117	0.0848	0.0848
Echinococcus multilocularis	mothers against decapentaplegic 5	0.0017	0.0042	0.0042
Mycobacterium tuberculosis	Conserved hypothetical protein	0.002	0.0067	0.4715
Trypanosoma brucei	DNA polymerase IV, putative	0.002	0.0067	0.0162
Loa Loa (eye worm)	hypothetical protein	0.002	0.0071	0.0041
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0022	0.0083	0.0083
Echinococcus multilocularis	smad	0.0017	0.0042	0.0042
Trichomonas vaginalis	conserved hypothetical protein	0.002	0.0068	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.0067	0.0162
Trypanosoma cruzi	PAB1-binding protein , putative	0.0026	0.0114	0.0252
Loa Loa (eye worm)	hypothetical protein	0.002	0.0071	0.0041
Brugia malayi	ImpB/MucB/SamB family protein	0.002	0.0067	0.0036
Leishmania major	4-coumarate:coa ligase-like protein	0.0024	0.0102	0.0212
Echinococcus multilocularis	atpase aaa+ type core atpase aaa type core	0.0672	0.5313	0.5313
Schistosoma mansoni	Smad4	0.0017	0.0042	0.0042
Schistosoma mansoni	smad1 5 8 and	0.0017	0.0042	0.0042
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.0067	0.0162
Echinococcus granulosus	mixed lineage leukemia protein mll	0.0022	0.0083	0.0083
Mycobacterium tuberculosis	Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase)	0.0024	0.0102	1
Loa Loa (eye worm)	steroid hormone receptor	0.002	0.0071	0.0041
Loa Loa (eye worm)	hypothetical protein	0.002	0.0071	0.0041
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0102	0.0077
Echinococcus granulosus	mothers against decapentaplegic 5	0.0017	0.0042	0.0042
Trypanosoma cruzi	DNA polymerase kappa, putative	0.002	0.0067	0.01
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.0067	0.0162
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.002	0.0071	0.0071
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.002	0.0071	0.0041
Echinococcus multilocularis	isocitrate dehydrogenase 2 (NADP+)	0.0016	0.0037	0.0037
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.002	0.0071	0.0041
Echinococcus granulosus	smad	0.0017	0.0042	0.0042
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.002	0.0071	0.0071
Echinococcus granulosus	sodium:glucose cotransporter	0.0117	0.0848	0.0848
Echinococcus multilocularis	dnaJ subfamily B	0.1255	1	1
Echinococcus multilocularis	GPCR, family 2	0.0047	0.0287	0.0287
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0053	0.0019
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0047	0.0287	0.0287
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.0067	0.0162
Toxoplasma gondii	LsmAD domain-containing protein	0.0026	0.0114	0.0634
Giardia lamblia	DINP protein human, muc B family	0.002	0.0067	0.5
Schistosoma mansoni	hypothetical protein	0.0102	0.0728	0.0728
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.002	0.0071	0.0041
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0017	0.0045	0.1199
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0287	0.0298
Echinococcus multilocularis	NADP dependent isocitrate dehydrogenase	0.0016	0.0037	0.0037
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0053	0.0019
Leishmania major	DNA polymerase eta, putative	0.002	0.0067	0.01
Loa Loa (eye worm)	ImpB/MucB/SamB family protein	0.002	0.0067	0.0036
Echinococcus multilocularis	sodium:glucose cotransporter 2	0.0117	0.0848	0.0848
Brugia malayi	Sodium:solute symporter family protein	0.0117	0.0848	0.0966
Schistosoma mansoni	hypothetical protein	0.0047	0.0287	0.0287
Schistosoma mansoni	steroid hormone receptor ad4bp	0.002	0.0071	0.0071
Plasmodium vivax	ataxin-2 like protein, putative	0.0026	0.0114	1
Loa Loa (eye worm)	hypothetical protein	0.002	0.0071	0.0041
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.0067	0.0162
Trypanosoma brucei	isocitrate dehydrogenase [NADP], mitochondrial precursor, putative	0.0016	0.0037	0.0062
Trypanosoma brucei	DNA polymerase IV, putative	0.002	0.0067	0.0162
Loa Loa (eye worm)	hypothetical protein	0.002	0.0071	0.0041
Schistosoma mansoni	nuclear hormone receptor	0.002	0.0071	0.0071
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0047	0.0287	0.0287
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.002	0.0071	0.0041
Brugia malayi	ImpB/MucB/SamB family protein	0.002	0.0067	0.0036
Schistosoma mansoni	cpg binding protein	0.0093	0.0656	0.0656
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0024	0.0102	0.244
Schistosoma mansoni	high-affinity choline transporter	0.106	0.8433	0.8433
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.002	0.0071	0.0071
Echinococcus multilocularis	high affinity choline transporter 1	0.106	0.8433	0.8433
Trichomonas vaginalis	conserved hypothetical protein	0.002	0.0068	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.0067	0.0162
Echinococcus granulosus	sodium coupled monocarboxylate transporter 1	0.0117	0.0848	0.0848
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.002	0.0068	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.002	0.0071	0.0041
Plasmodium falciparum	ataxin-2 like protein, putative	0.0026	0.0114	1
Trichomonas vaginalis	conserved hypothetical protein	0.002	0.0068	1
Onchocerca volvulus		0.0117	0.0848	0.743
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.002	0.0071	0.0041
Trypanosoma brucei	DNA polymerase IV, putative	0.002	0.0067	0.0162
Echinococcus multilocularis	isocitrate dehydrogenase	0.0016	0.0037	0.0037
Schistosoma mansoni	smad1 5 8 and	0.0017	0.0042	0.0042
Schistosoma mansoni	thyroid hormone receptor	0.002	0.0071	0.0071
Brugia malayi	nuclear receptor NHR-88	0.002	0.0071	0.0041
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.002	0.0071	0.0071

Activities

Activity type	Activity value	Assay description	Source	Reference
Activity (functional)	= -12 %	Antidiabetic activity in C57B6N mouse assessed as decrease in beta-hydroxybutyrate at 3 mg/kg, po	ChEMBL.	20832306
Activity (functional)	= 28 %	Antidiabetic activity in C57B6N mouse assessed as blood glucose correction at 3 mg/kg, po	ChEMBL.	20832306
Activity (functional)	= 48 %	Antidiabetic activity in C57B6N mouse assessed as blood glucose correction at 30 mg/kg, po	ChEMBL.	20832306
Activity (functional)	= 53 %	Antidiabetic activity in C57B6N mouse assessed as blood glucose correction at 10 mg/kg, po	ChEMBL.	20832306
Activity (functional)	= 53 %	Antidiabetic activity in C57B6N mouse assessed as decrease in beta-hydroxybutyrate at 10 mg/kg, po	ChEMBL.	20832306
Activity (functional)	= 60 %	Antidiabetic activity in C57B6N mouse assessed as decrease in beta-hydroxybutyrate at 30 mg/kg, po	ChEMBL.	20832306
EC50 (binding)	= 500 nM	Inhibition of MCD in mouse hepatocytes by whole cell assay	ChEMBL.	20832306
IC50 (binding)	= 0.9 nM	Inhibition of human MCD	ChEMBL.	20832306

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: CHEMBL1258367

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1262380