TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 504.023 | Formula: C28H30ClN5O2
H donors: 2 H acceptors: 3 LogP: 5.14 Rotable bonds: 8
Rule of 5 violations (Lipinski): 2
SMILES: ON=C1CCc2c1ccc(c2)c1nc([nH]c1c1ccncc1)c1ccc(cc1)OCCCN(C)C.Cl
InChi: 1S/C28H29N5O2.ClH/c1-33(2)16-3-17-35-23-8-4-20(5-9-23)28-30-26(19-12-14-29-15-13-19)27(31-28)22-6-10-24-21(18-22)7-11-25(24)32-34;/h4-6,8-10,12-15,18,34H,3,7,11,16-17H2,1-2H3,(H,30,31);1H
InChiKey: HHCPSVHMLHGMPH-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

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
Onchocerca volvulus		0.006	0.0251	0.0425
Schistosoma mansoni	acetyl-CoA C-acetyltransferase	0.0095	0.0648	0.1325
Schistosoma mansoni	rab6-interacting	0.006	0.0251	0.0513
Brugia malayi	Bromodomain containing protein	0.0162	0.139	0.2217
Brugia malayi	latrophilin 2 splice variant baaae	0.021	0.1919	0.3062
Schistosoma mansoni	hypothetical protein	0.0097	0.0667	0.1362
Echinococcus granulosus	intermediate filament protein	0.0054	0.0193	0.0193
Brugia malayi	jmjC domain containing protein	0.0059	0.0246	0.0393
Echinococcus multilocularis	methyl CpG binding domain protein 2	0.0072	0.039	0.039
Echinococcus multilocularis	GPCR, family 2	0.0097	0.0667	0.0667
Loa Loa (eye worm)	hypothetical protein	0.0053	0.0182	0.0351
Loa Loa (eye worm)	PHD-finger family protein	0.0183	0.1628	0.3132
Trypanosoma brucei	ISWI complex protein	0.0065	0.0308	1
Brugia malayi	Doublecortin family protein	0.006	0.0251	0.04
Brugia malayi	hypothetical protein	0.0166	0.1434	0.2288
Schistosoma mansoni	hypothetical protein	0.0097	0.0667	0.1362
Plasmodium vivax	hypothetical protein, conserved	0.006	0.0254	0.068
Echinococcus multilocularis	lysine specific demethylase 6a	0.0059	0.0246	0.0246
Schistosoma mansoni	jumonji/arid domain-containing protein	0.023	0.2147	0.4385
Echinococcus multilocularis	survival motor neuron protein 1	0.0237	0.2227	0.2227
Brugia malayi	jmjC domain containing protein	0.0059	0.0246	0.0393
Giardia lamblia	PHD finger protein 15	0.0183	0.1628	0.5
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0072	0.039	0.0797
Loa Loa (eye worm)	doublecortin family protein	0.006	0.0251	0.0483
Schistosoma mansoni	tar DNA-binding protein	0.0264	0.2523	0.5154
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0154	0.0297
Echinococcus granulosus	tar DNA binding protein	0.0264	0.2523	0.2523
Onchocerca volvulus		0.0101	0.0714	0.2001
Brugia malayi	hypoxia-induced factor 1	0.0153	0.1291	0.206
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0047	0.0105	0.0215
Echinococcus multilocularis	atpase aaa+ type core atpase aaa type core	0.0814	0.8639	0.8639
Loa Loa (eye worm)	TAR-binding protein	0.0264	0.2523	0.4855
Loa Loa (eye worm)	intermediate filament protein	0.0054	0.0193	0.0372
Brugia malayi	MH2 domain containing protein	0.0504	0.5197	0.829
Trypanosoma brucei	PAB1-binding protein , putative	0.0051	0.0154	0.5017
Brugia malayi	Bromodomain containing protein	0.0193	0.1739	0.2774
Brugia malayi	RNA binding protein	0.0264	0.2523	0.4025
Loa Loa (eye worm)	hypothetical protein	0.0172	0.1505	0.2895
Loa Loa (eye worm)	hypothetical protein	0.0183	0.1628	0.3132
Schistosoma mansoni	hypothetical protein	0.0097	0.0667	0.1362
Loa Loa (eye worm)	hypothetical protein	0.021	0.1919	0.3693
Schistosoma mansoni	aryl hydrocarbon receptor	0.0049	0.0138	0.0282
Brugia malayi	RNA recognition motif domain containing protein	0.0264	0.2523	0.4025
Trichomonas vaginalis	inositol monophosphatase, putative	0.0037	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.0101	0.0714	0.1374
Trypanosoma brucei	JmjC domain, hydroxylase, putative	0.0059	0.0246	0.8002
Loa Loa (eye worm)	hypothetical protein	0.0059	0.0246	0.0474
Loa Loa (eye worm)	hypothetical protein	0.006	0.0251	0.0483
Echinococcus multilocularis	arachidonate 5 lipoxygenase	0.0294	0.2855	0.2855
Echinococcus granulosus	Polycystic kidney disease protein	0.006	0.0251	0.0251
Echinococcus granulosus	histone lysine methyltransferase setb	0.0072	0.039	0.039
Echinococcus multilocularis	Polycystic kidney disease protein	0.006	0.0251	0.0251
Echinococcus granulosus	Transcription factor JmjC domain containing protein	0.0601	0.6269	0.6269
Brugia malayi	PHD-finger family protein	0.0105	0.076	0.1212
Brugia malayi	hypothetical protein	0.0237	0.2227	0.3553
Echinococcus granulosus	lamin dm0	0.0054	0.0193	0.0193
Loa Loa (eye worm)	hypothetical protein	0.0237	0.2227	0.4286
Brugia malayi	intermediate filament protein	0.0054	0.0193	0.0309
Schistosoma mansoni	single-minded	0.0049	0.0138	0.0282
Echinococcus granulosus	lipoxygenase domain containing protein	0.006	0.0251	0.0251
Echinococcus granulosus	lamin	0.0054	0.0193	0.0193
Echinococcus multilocularis	zinc finger protein	0.0083	0.0509	0.0509
Echinococcus multilocularis	jumonji domain containing protein	0.0255	0.2426	0.2426
Echinococcus multilocularis	lamin	0.0054	0.0193	0.0193
Schistosoma mansoni	hypothetical protein	0.006	0.0251	0.0513
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0307	0.2999	0.577
Schistosoma mansoni	hypothetical protein	0.0048	0.0126	0.0258
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0307	0.2999	0.4783
Schistosoma mansoni	lamin	0.0054	0.0193	0.0395
Echinococcus multilocularis	PHD finger protein rhinoceros	0.0183	0.1628	0.1628
Brugia malayi	jmjC domain containing protein	0.023	0.2147	0.3424
Brugia malayi	TAR-binding protein	0.0264	0.2523	0.4025
Echinococcus multilocularis	Transcription factor, JmjC domain containing protein	0.0601	0.6269	0.6269
Plasmodium falciparum	phd finger protein, putative	0.0183	0.1628	1
Echinococcus multilocularis	JmjC domain containing protein 4	0.0059	0.0246	0.0246
Trichomonas vaginalis	myo inositol monophosphatase, putative	0.0037	0	0.5
Brugia malayi	Latrophilin receptor protein 2	0.0097	0.0667	0.1064
Schistosoma mansoni	methyl-cpg binding protein mbd	0.0072	0.039	0.0797
Loa Loa (eye worm)	hypothetical protein	0.018	0.1594	0.3068
Onchocerca volvulus		0.0312	0.3063	1
Echinococcus multilocularis	lipoxygenase domain containing protein	0.006	0.0251	0.0251
Schistosoma mansoni	hypothetical protein	0.0065	0.0308	0.0628
Schistosoma mansoni	jumonji domain containing protein	0.0477	0.4895	1
Plasmodium vivax	JmjC domain containing protein	0.0059	0.0246	0.0623
Schistosoma mansoni	lamin	0.0054	0.0193	0.0395
Schistosoma mansoni	jumonji/arid domain-containing protein	0.023	0.2147	0.4385
Echinococcus multilocularis	neuropeptide s receptor	0.0936	1	1
Toxoplasma gondii	LsmAD domain-containing protein	0.0051	0.0154	0.0948
Plasmodium falciparum	LCCL domain-containing protein	0.006	0.0251	0.0656
Loa Loa (eye worm)	hypothetical protein	0.006	0.0251	0.0483
Echinococcus granulosus	bromodomain adjacent to zinc finger domain	0.0253	0.2397	0.2397
Schistosoma mansoni	intermediate filament proteins	0.0054	0.0193	0.0395
Loa Loa (eye worm)	hypoxia-induced factor 1	0.0153	0.1291	0.2485
Echinococcus granulosus	survival motor neuron protein 1	0.0237	0.2227	0.2227
Brugia malayi	jmjC domain containing protein	0.0601	0.6269	1
Loa Loa (eye worm)	hypothetical protein	0.0312	0.3063	0.5895
Echinococcus multilocularis	geminin	0.0342	0.3397	0.3397
Onchocerca volvulus		0.0054	0.0193	0.0229
Echinococcus granulosus	RUN	0.006	0.0251	0.0251
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0047	0.0105	0.0215
Toxoplasma gondii	PHD-finger domain-containing protein	0.0183	0.1628	1
Echinococcus multilocularis	bromodomain adjacent to zinc finger domain	0.0152	0.1278	0.1278
Brugia malayi	AF-10 protein	0.006	0.0254	0.0406
Echinococcus multilocularis	musashi	0.0054	0.0193	0.0193
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0047	0.0105	0.0105
Loa Loa (eye worm)	jmjC domain-containing protein	0.0059	0.0246	0.0474
Plasmodium vivax	multidomain scavenger receptor, putative	0.006	0.0251	0.0656
Echinococcus granulosus	peregrin	0.0193	0.1739	0.1739
Echinococcus granulosus	jumonji domain containing protein	0.0255	0.2426	0.2426
Trypanosoma cruzi	ISWI complex protein	0.0065	0.0308	1
Echinococcus granulosus	GPCR family 2	0.0097	0.0667	0.0667
Echinococcus granulosus	geminin	0.0342	0.3397	0.3397
Echinococcus multilocularis	jumonji domain containing 1A	0.0059	0.0246	0.0246
Loa Loa (eye worm)	hypothetical protein	0.0054	0.0193	0.0372
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0047	0.0105	0.0105
Leishmania major	hypothetical protein, conserved	0.0059	0.0246	0.8002
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0264	0.2523	0.4855
Echinococcus granulosus	arachidonate 5 lipoxygenase	0.0294	0.2855	0.2855
Loa Loa (eye worm)	hypothetical protein	0.0068	0.0344	0.0663
Echinococcus multilocularis	RUN	0.006	0.0251	0.0251
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0097	0.0667	0.1283
Loa Loa (eye worm)	bromodomain containing protein	0.0075	0.0419	0.0806
Brugia malayi	PAS domain containing protein	0.0049	0.0138	0.022
Loa Loa (eye worm)	hypothetical protein	0.0314	0.3085	0.5936
Echinococcus granulosus	phd:f box containing protein	0.0059	0.0246	0.0246
Echinococcus multilocularis	neuropeptide receptor A26	0.0936	1	1
Schistosoma mansoni	jumonji domain containing protein	0.0059	0.0246	0.0503
Echinococcus granulosus	zinc finger protein	0.0083	0.0509	0.0509
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0072	0.039	0.039
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0047	0.0105	0.0105
Wolbachia endosymbiont of Brugia malayi	fructose-1,6-bisphosphatase	0.0037	0	0.5
Schistosoma mansoni	tar DNA-binding protein	0.0264	0.2523	0.5154
Brugia malayi	Bromodomain containing protein	0.0317	0.3117	0.4972
Schistosoma mansoni	survival motor neuron protein	0.0048	0.0126	0.0258
Schistosoma mansoni	zinc finger protein	0.0083	0.0509	0.1039
Echinococcus granulosus	Jumonji AT rich interactive domain 1B	0.0067	0.0336	0.0336
Echinococcus granulosus	JmjC domain containing protein 4	0.0059	0.0246	0.0246
Brugia malayi	Iron-sulfur cluster assembly accessory protein	0.0048	0.0126	0.0201
Echinococcus multilocularis	bromodomain adjacent to zinc finger domain	0.0253	0.2397	0.2397
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0097	0.0667	0.0667
Entamoeba histolytica	myo-inositol monophosphatase, putative	0.0037	0	0.5
Echinococcus granulosus	fetal alzheimer antigen falz	0.0095	0.0648	0.0648
Leishmania major	hypothetical protein, conserved	0.0065	0.0308	1
Schistosoma mansoni	hypothetical protein	0.0087	0.0559	0.1141
Plasmodium falciparum	JmjC domain-containing protein, putative	0.0059	0.0246	0.0623
Loa Loa (eye worm)	RNA binding protein	0.0264	0.2523	0.4855
Loa Loa (eye worm)	hypothetical protein	0.0162	0.1393	0.2681
Leishmania major	hypothetical protein, conserved	0.0051	0.0154	0.5017
Schistosoma mansoni	hypothetical protein	0.0183	0.1628	0.3325
Loa Loa (eye worm)	hypothetical protein	0.0307	0.2999	0.577
Loa Loa (eye worm)	jmjC domain-containing protein	0.0059	0.0246	0.0474
Loa Loa (eye worm)	jmjC domain-containing protein	0.0059	0.0246	0.0474
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0047	0.0105	0.0168
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0097	0.0667	0.0667
Schistosoma mansoni	zinc finger protein	0.0065	0.0308	0.0628
Echinococcus multilocularis	Jumonji, AT rich interactive domain 1B	0.0067	0.0336	0.0336
Trichomonas vaginalis	myo inositol monophosphatase, putative	0.0037	0	0.5
Trypanosoma cruzi	ISWI complex protein	0.0065	0.0308	1
Onchocerca volvulus	Alhambra homolog	0.0183	0.1628	0.5112
Loa Loa (eye worm)	jmjC domain-containing protein	0.023	0.2147	0.4131
Schistosoma mansoni	hypothetical protein	0.021	0.1919	0.3921
Onchocerca volvulus		0.0054	0.0193	0.0229
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0047	0.0105	0.0215
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0097	0.0667	0.0667
Trypanosoma brucei	PHD-zinc-finger like domain containing protein, putative	0.006	0.0254	0.8272
Loa Loa (eye worm)	PHD-finger family protein	0.0087	0.0559	0.1075
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.006	0.0254	0.052
Schistosoma mansoni	protein phosphatase 2C	0.0059	0.0246	0.0503
Echinococcus granulosus	PHD finger protein rhinoceros	0.0183	0.1628	0.1628
Echinococcus multilocularis	lysine specific demethylase 5A	0.0222	0.2057	0.2057
Plasmodium vivax	hypothetical protein, conserved	0.0183	0.1628	1
Loa Loa (eye worm)	hypothetical protein	0.0072	0.039	0.0751
Echinococcus granulosus	lysine specific demethylase 5A	0.023	0.2147	0.2147
Echinococcus granulosus	methyl CpG binding domain protein 2	0.0072	0.039	0.039
Toxoplasma gondii	PHD-finger domain-containing protein	0.006	0.0254	0.1563
Schistosoma mansoni	methyl-cpg binding protein mbd	0.0072	0.039	0.0797
Brugia malayi	F/Y-rich N-terminus family protein	0.0068	0.0344	0.0549
Schistosoma mansoni	lipoxygenase	0.0294	0.2855	0.5832
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0047	0.0105	0.0105
Echinococcus multilocularis	lamin dm0	0.0054	0.0193	0.0193
Brugia malayi	hypothetical protein	0.0051	0.0154	0.0246
Schistosoma mansoni	hypothetical protein	0.0097	0.0667	0.1362
Echinococcus multilocularis	tar DNA binding protein	0.0264	0.2523	0.2523
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0072	0.039	0.0797
Brugia malayi	jmjC domain containing protein	0.0059	0.0246	0.0393
Loa Loa (eye worm)	transcription factor SMAD2	0.0504	0.5197	1
Plasmodium falciparum	conserved Plasmodium membrane protein, unknown function	0.006	0.0254	0.068
Schistosoma mansoni	tar DNA-binding protein	0.0264	0.2523	0.5154
Schistosoma mansoni	hypothetical protein	0.0342	0.3397	0.6938
Echinococcus multilocularis	tumor protein p63	0.0692	0.7281	0.7281
Schistosoma mansoni	tar DNA-binding protein	0.0264	0.2523	0.5154
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0054	0.0193	0.0372
Toxoplasma gondii	PHD-finger domain-containing protein	0.0183	0.1628	1
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0234	0.2191	0.5
Schistosoma mansoni	cellular tumor antigen P53	0.0101	0.0714	0.1458
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0097	0.0667	0.0667
Echinococcus multilocularis	phd:f box containing protein	0.0059	0.0246	0.0246
Echinococcus granulosus	neuropeptide receptor A26	0.0936	1	1
Brugia malayi	PHD-finger family protein	0.0068	0.0344	0.0549
Schistosoma mansoni	lipoxygenase	0.0186	0.1661	0.3393
Schistosoma mansoni	hypothetical protein	0.006	0.0254	0.052
Mycobacterium ulcerans	extragenic suppressor protein SuhB	0.0037	0	0.5
Trypanosoma cruzi	JmjC domain, hydroxylase, putative	0.0059	0.0246	0.8002
Echinococcus multilocularis	peregrin	0.0193	0.1739	0.1739
Trypanosoma brucei	PHD-zinc-finger like domain containing protein, putative	0.006	0.0254	0.8272
Schistosoma mansoni	tar DNA-binding protein	0.0264	0.2523	0.5154
Echinococcus granulosus	lysine specific demethylase 6a	0.0059	0.0246	0.0246
Echinococcus granulosus	lipoxygenase domain containing protein	0.006	0.0251	0.0251
Brugia malayi	jmjC domain containing protein	0.0059	0.0246	0.0393
Schistosoma mansoni	hypothetical protein	0.0342	0.3397	0.6938
Trypanosoma cruzi	JmjC domain, hydroxylase, putative	0.0059	0.0246	0.8002
Schistosoma mansoni	polycystin 1-related	0.006	0.0251	0.0513
Echinococcus granulosus	jumonji domain containing 1A	0.0059	0.0246	0.0246
Brugia malayi	hypothetical protein	0.006	0.0251	0.04
Loa Loa (eye worm)	jmjC domain-containing protein	0.0379	0.38	0.7311
Brugia malayi	follicle stimulating hormone receptor	0.0237	0.2227	0.3552
Schistosoma mansoni	phosphatidylserine receptor	0.0059	0.0246	0.0503
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0237	0.2227	0.4284
Brugia malayi	Intermediate filament tail domain containing protein	0.0054	0.0193	0.0309
Toxoplasma gondii	WD domain, G-beta repeat-containing protein	0.006	0.0254	0.1563
Schistosoma mansoni	ubiquitously transcribed sex (X/Y) chromosome tetratricopeptide repeat protein-related	0.0059	0.0246	0.0503
Echinococcus granulosus	tumor protein p63	0.0692	0.7281	0.7281
Loa Loa (eye worm)	hypothetical protein	0.0166	0.1434	0.276
Schistosoma mansoni	bromodomain-containing nuclear protein 1 brd1	0.0183	0.1628	0.3325
Trypanosoma cruzi	PAB1-binding protein , putative	0.0051	0.0154	0.5017
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0307	0.2999	0.4783
Schistosoma mansoni	phd/f-box containing protein	0.0059	0.0246	0.0503
Brugia malayi	hypothetical protein	0.0312	0.3063	0.4887
Schistosoma mansoni	rab6-interacting	0.006	0.0251	0.0513
Trypanosoma cruzi	PAB1-binding protein , putative	0.0051	0.0154	0.5017
Loa Loa (eye worm)	MH2 domain-containing protein	0.0504	0.5197	1
Loa Loa (eye worm)	hypothetical protein	0.0299	0.2915	0.561
Toxoplasma gondii	histone lysine demethylase JMJD6a	0.0059	0.0246	0.1512
Brugia malayi	PHD-finger family protein	0.0183	0.1628	0.2596
Loa Loa (eye worm)	hypothetical protein	0.0097	0.0667	0.1283
Schistosoma mansoni	loxhd1	0.006	0.0251	0.0513
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0047	0.0105	0.0203
Toxoplasma gondii	histone lysine demethylase JMJC1/KDM5D/JARID1D	0.0059	0.0246	0.1512
Loa Loa (eye worm)	hypothetical protein	0.0059	0.0246	0.0474
Brugia malayi	hypothetical protein	0.006	0.0251	0.04
Onchocerca volvulus		0.006	0.0251	0.0425
Schistosoma mansoni	bromodomain containing protein	0.0268	0.2565	0.524
Echinococcus multilocularis	fetal alzheimer antigen, falz	0.0095	0.0648	0.0648
Echinococcus granulosus	bromodomain adjacent to zinc finger domain	0.0152	0.1278	0.1278
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0097	0.0667	0.1064
Echinococcus multilocularis	lipoxygenase domain containing protein	0.006	0.0251	0.0251

Activities

Activity type	Activity value	Assay description	Source	Reference
Inhibition (functional)	= 0 %	GSK_TCMDC: Inhibition of Plasmodium falciparum 3D7 LDH activity, using an LDH reporter assay. Test compounds present at 2uM	ChEMBL.	20485427
Inhibition (functional)	= 1.24 %	ST_JUDE_LEISH: Cytotoxicity at 2uM final concentration against transgenic Leishmania Mexicana promastigotes LmGT2 that are glucose transport deficient and complemented with the L. Mexicana glucose transporter 2. Activity is measured by by DNA content using SYBR green in vitro	ChEMBL.	No reference
Inhibition (functional)	= 2.33 %	ST_JUDE_LEISH: Cytotoxicity at 2uM final concentration against transgenic Leishmania Mexicana promastigotes LmPfHT that are glucose transport deficient and complemented with the Plasmodium falciparum hexose transporter. Activity is measured by by DNA content using SYBR green in vitro	ChEMBL.	No reference
Inhibition (functional)	= 2.55 %	ST_JUDE_LEISH: Cytotoxicity at 2uM final concentration against transgenic Leishmania Mexicana promastigotes LmGLUT1 that are glucose transport deficient and complemented with the human glucose transporter GLUT1. Activity is measured by DNA content using SYBR green in vitro	ChEMBL.	No reference
Inhibition (functional)	= 63 %	GSK_TCMDC: Inhibition of Plasmodium falciparum Dd2 in whole red blood cells, using parasite LDH activity as an index of growth. Test compounds present at 2uM	ChEMBL.	20485427
Inhibition (functional)	= 68 %	GSK_TCMDC: Percent inhibition of human HepG2 cell line. Test compounds present at 10uM.	ChEMBL.	20485427
Inhibition (functional)	= 96 %	GSK_TCMDC: Inhibition of Plasmodium falciparum 3D7 in whole red blood cells, using parasite LDH activity as an index of growth. Test compounds present at 2uM	ChEMBL.	20485427
Inhibition frequency index (IFI) (functional)	= 5.19	Inhibition Frequency Index (IFI)	GSK.	20485427
Percent growth inhibition (functional)	= -3 %	Percent inhibition of P. falciparum lactate dehydrogenase activity (at 2 uM)	GSK.	20485427
Percent growth inhibition (functional)	= 63 %	Percent inhibition of P. falciparum Dd2 growth (at 2 uM)	GSK.	20485427
Percent growth inhibition (functional)	= 68 %	Percent inhibition of HepG2 growth (at 10 uM)	GSK.	20485427
Percent growth inhibition (functional)	= 96 %	Percent inhibition of P. falciparum 3D7 growth (at 2 uM)	GSK.	20485427
XC50 (functional)	= 6.08	XC50 determination of P. falciparum 3D7 growth	GSK.	20485427
XC50 (functional)	= 0.83239 uM	GSK_TCMDC: Inhibition of Plasmodium falciparum 3D7 in whole erythrocytes, using parasite LDH activity as an index of growth.	ChEMBL.	20485427

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.

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External resources for this compound

ChEMBL: CHEMBL529137
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Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 602397