TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 533.978 | Formula: C29H25ClFN3O4
H donors: 1 H acceptors: 3 LogP: 4.89 Rotable bonds: 8
Rule of 5 violations (Lipinski): 2
SMILES: OC(=O)CCCCc1nc2cc(ccc2c(=O)n1c1ccc(cc1)F)C1=NO[C@@](C1)(C)c1ccc(cc1)Cl
InChi: 1S/C29H25ClFN3O4/c1-29(19-7-9-20(30)10-8-19)17-25(33-38-29)18-6-15-23-24(16-18)32-26(4-2-3-5-27(35)36)34(28(23)37)22-13-11-21(31)12-14-22/h6-16H,2-5,17H2,1H3,(H,35,36)/t29-/m1/s1
InChiKey: PISYFHHBEMNTSJ-GDLZYMKVSA-N

Network

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Target Layer

Model Organisms

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

TDR Pathogens:

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

Other Pathogens:

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

Compound Layer

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Clustering layers

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	prostaglandin D2 receptor 2	Starlite/ChEMBL	References

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)	tyrosyl-DNA phosphodiesterase	0.0064	0.064	0.0934
Echinococcus multilocularis	jumonji domain containing 1A	0.0049	0.045	0.0515
Onchocerca volvulus		0.009	0.0971	0.1063
Trypanosoma brucei	PHD-zinc-finger like domain containing protein, putative	0.0035	0.0261	0.383
Mycobacterium leprae	PROBABLE NADH DEHYDROGENASE NDH	0.0106	0.117	0.172
Schistosoma mansoni	survival motor neuron protein	0.009	0.0966	0.1234
Treponema pallidum	fructose-bisphosphate aldolase	0.0801	1	1
Brugia malayi	hypothetical protein	0.0441	0.5432	0.7933
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0028	0.0175	0.0196
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0156	0.0227
Trichomonas vaginalis	chromobox protein, putative	0.0068	0.0685	0.0661
Echinococcus multilocularis	lysine specific demethylase 5A	0.0185	0.2179	0.2618
Brugia malayi	hypothetical protein	0.0145	0.1667	0.2435
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0079	0.0829	0.1054
Mycobacterium tuberculosis	Probable UDP-N-acetylglucosamine pyrophosphorylase GlmU	0.0486	0.6007	1
Loa Loa (eye worm)	jmjC domain-containing protein	0.0049	0.045	0.0657
Schistosoma mansoni	lamin	0.0026	0.0156	0.017
Entamoeba histolytica	hypothetical protein	0.0035	0.0271	0.0067
Plasmodium vivax	glutathione reductase, putative	0.0046	0.0413	0.3387
Entamoeba histolytica	tyrosyl-DNA phosphodiesterase, putative	0.0064	0.064	0.0444
Trichomonas vaginalis	set domain proteins, putative	0.0629	0.7818	0.7812
Loa Loa (eye worm)	hypothetical protein	0.0079	0.0829	0.121
Loa Loa (eye worm)	hypothetical protein	0.01	0.1095	0.1598
Trypanosoma cruzi	myo-inositol-1(or 4)-monophosphatase 1, putative	0.003	0.0205	0.2918
Echinococcus multilocularis	tyrosyl DNA phosphodiesterase 1	0.0064	0.064	0.0746
Loa Loa (eye worm)	hypothetical protein	0.0049	0.045	0.0657
Plasmodium falciparum	JmjC domain-containing protein, putative	0.0049	0.045	0.3716
Schistosoma mansoni	phd/f-box containing protein	0.0049	0.045	0.0557
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.0079	0.0829	0.7038
Loa Loa (eye worm)	thioredoxin reductase	0.0046	0.0413	0.0602
Toxoplasma gondii	thioredoxin reductase	0.0046	0.0413	0.3387
Brugia malayi	F/Y-rich N-terminus family protein	0.0038	0.0298	0.0436
Loa Loa (eye worm)	hypothetical protein	0.0026	0.015	0.0218
Brugia malayi	Intermediate filament tail domain containing protein	0.0026	0.0156	0.0228
Brugia malayi	chromobox protein homolog 3	0.0038	0.0306	0.0446
Echinococcus multilocularis	musashi	0.0026	0.0156	0.0157
Echinococcus multilocularis	transcription factor Dp 1	0.0037	0.0295	0.0327
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0028	0.0175	0.0256
Mycobacterium tuberculosis	Putative ferredoxin reductase	0.0106	0.117	0.1912
Echinococcus granulosus	histone lysine methyltransferase setb	0.0079	0.0829	0.1054
Onchocerca volvulus	Heterochromatin protein 1 homolog	0.0038	0.0306	0.0196
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0087	0.0931	0.1187
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0185	0.2179	0.2827
Schistosoma mansoni	tyrosyl-DNA phosphodiesterase	0.0064	0.064	0.0805
Schistosoma mansoni	hypothetical protein	0.0028	0.0175	0.0196
Echinococcus granulosus	jumonji domain containing protein	0.0147	0.1694	0.219
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0306	0.0446
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0801	1	1
Brugia malayi	jmjC domain containing protein	0.0049	0.045	0.0658
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0087	0.0931	0.1187
Echinococcus multilocularis	GPCR, family 2	0.0028	0.0175	0.0181
Mycobacterium ulcerans	fructose-bisphosphate aldolase	0.0391	0.4794	0.7972
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.009	0.0971	0.124
Echinococcus granulosus	intermediate filament protein	0.0026	0.0156	0.017
Echinococcus multilocularis	Transcription factor, JmjC domain containing protein	0.0404	0.4958	0.5997
Mycobacterium tuberculosis	Probable reductase	0.0106	0.117	0.1912
Echinococcus granulosus	Jumonji AT rich interactive domain 1B	0.0049	0.045	0.0557
Schistosoma mansoni	inositol monophosphatase	0.003	0.0205	0.0235
Loa Loa (eye worm)	PHD-finger family protein	0.0106	0.1167	0.1704
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0079	0.0829	0.1054
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0261	0.0381
Trichomonas vaginalis	chromobox protein, putative	0.0041	0.0342	0.0317
Schistosoma mansoni	hypothetical protein	0.0615	0.7642	1
Mycobacterium tuberculosis	Probable oxidoreductase	0.0118	0.1321	0.2164
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0175	0.0255
Leishmania major	hypothetical protein, conserved	0.0049	0.045	0.691
Brugia malayi	Thioredoxin reductase	0.0046	0.0413	0.0603
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0038	0.0298	0.0357
Echinococcus granulosus	transcription factor Dp 1	0.0037	0.0295	0.0353
Echinococcus multilocularis	chromobox protein 1	0.0068	0.0685	0.0801
Echinococcus granulosus	JmjC domain containing protein 4	0.0049	0.045	0.0557
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0088	0.094	0.1371
Brugia malayi	PHD-finger family protein	0.0035	0.0261	0.0382
Echinococcus multilocularis	survival motor neuron protein 1	0.0441	0.5432	0.6574
Schistosoma mansoni	chromobox protein	0.0068	0.0685	0.0865
Mycobacterium tuberculosis	Probable fructose-bisphosphate aldolase Fba	0.0391	0.4794	0.7972
Schistosoma mansoni	hypothetical protein	0.0028	0.0175	0.0196
Trichomonas vaginalis	myo inositol monophosphatase, putative	0.003	0.0205	0.0179
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.0079	0.0829	0.0976
Onchocerca volvulus		0.009	0.0966	0.1057
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0028	0.0175	0.0181
Trypanosoma brucei	JmjC domain, hydroxylase, putative	0.0049	0.045	0.691
Toxoplasma gondii	histone lysine demethylase JMJC1/KDM5D/JARID1D	0.0049	0.045	0.3716
Echinococcus multilocularis	lamin	0.0026	0.0156	0.0157
Loa Loa (eye worm)	hypothetical protein	0.0197	0.2323	0.3392
Trypanosoma cruzi	JmjC domain, hydroxylase, putative	0.0049	0.045	0.691
Echinococcus multilocularis	lamin dm0	0.0026	0.0156	0.0157
Mycobacterium ulcerans	hypothetical protein	0.0089	0.0956	0.1554
Loa Loa (eye worm)	hypothetical protein	0.0148	0.1698	0.2479
Echinococcus granulosus	thioredoxin glutathione reductase	0.0046	0.0413	0.0507
Echinococcus multilocularis	thioredoxin glutathione reductase	0.0046	0.0413	0.047
Echinococcus granulosus	PHD finger protein rhinoceros	0.0106	0.1167	0.1498
Brugia malayi	Iron-sulfur cluster assembly accessory protein	0.009	0.0966	0.1411
Brugia malayi	jmjC domain containing protein	0.0049	0.045	0.0658
Echinococcus granulosus	chromobox protein 1	0.0068	0.0685	0.0865
Trichomonas vaginalis	conserved hypothetical protein	0.0027	0.0164	0.0138
Brugia malayi	Tyrosyl-DNA phosphodiesterase family protein	0.0064	0.064	0.0935
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0801	1	1
Giardia lamblia	Fructose-bisphosphate aldolase	0.0801	1	1
Echinococcus granulosus	lysine specific demethylase 5A	0.0185	0.2179	0.2827
Brugia malayi	dihydrolipoyl dehydrogenase, mitochondrial precursor, putative	0.0016	0.0026	0.0039
Echinococcus granulosus	survival motor neuron protein 1	0.0441	0.5432	0.7098
Onchocerca volvulus	Rap guanine nucleotide exchange factor 1 homolog	0.0148	0.1698	0.2012
Toxoplasma gondii	eukaryotic initiation factor-2B, gamma subunit, putative	0.0089	0.0956	0.8146
Plasmodium vivax	SET domain protein, putative	0.0079	0.0829	0.7038
Loa Loa (eye worm)	glutathione reductase	0.0046	0.0413	0.0602
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0087	0.0931	0.11
Brugia malayi	Pre-SET motif family protein	0.0553	0.6847	1
Echinococcus granulosus	geminin	0.0615	0.7642	1
Entamoeba histolytica	hypothetical protein	0.0035	0.0271	0.0067
Brugia malayi	Heterochromatin protein 1	0.0068	0.0685	0.1001
Brugia malayi	Inositol-1	0.003	0.0205	0.03
Brugia malayi	latrophilin 2 splice variant baaae	0.006	0.0586	0.0856
Trichomonas vaginalis	chromobox protein, putative	0.0041	0.0342	0.0317
Mycobacterium leprae	Probable UDP-N-acetylglucosamine pyrophosphorylase GlmU	0.0486	0.6007	1
Trypanosoma brucei	PHD-zinc-finger like domain containing protein, putative	0.0035	0.0261	0.383
Schistosoma mansoni	jumonji domain containing protein	0.0333	0.4052	0.5286
Loa Loa (eye worm)	jmjC domain-containing protein	0.0219	0.26	0.3796
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0801	1	1
Loa Loa (eye worm)	intermediate filament protein	0.0026	0.0156	0.0227
Loa Loa (eye worm)	hypothetical protein	0.01	0.1095	0.1598
Mycobacterium ulcerans	molybdopterin-guanine dinucleotide biosynthesis protein A	0.0089	0.0956	0.1554
Echinococcus granulosus	peregrin	0.0106	0.1167	0.1498
Schistosoma mansoni	lamin	0.0026	0.0156	0.017
Toxoplasma gondii	histone lysine demethylase JMJD6a	0.0049	0.045	0.3716
Echinococcus granulosus	inositol monophosphatase 1	0.003	0.0205	0.0235
Echinococcus multilocularis	jumonji domain containing protein	0.0147	0.1694	0.2028
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0035	0.0271	0.0322
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0087	0.0931	0.1187
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0079	0.0829	0.1054
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0028	0.0175	0.0181
Echinococcus granulosus	lysine specific demethylase 6a	0.0049	0.045	0.0557
Echinococcus multilocularis	geminin	0.0615	0.7642	0.9262
Echinococcus multilocularis	phd:f box containing protein	0.0049	0.045	0.0515
Echinococcus multilocularis	chromobox protein 1	0.0068	0.0685	0.0801
Schistosoma mansoni	bromodomain-containing nuclear protein 1 brd1	0.0106	0.1167	0.1498
Plasmodium falciparum	conserved Plasmodium membrane protein, unknown function	0.0035	0.0261	0.206
Brugia malayi	Bromodomain containing protein	0.0106	0.1167	0.1705
Loa Loa (eye worm)	hypothetical protein	0.003	0.0201	0.0293
Leishmania major	myo-inositol-1(or 4)-monophosphatase 1, putative	0.003	0.0205	0.2918
Echinococcus granulosus	phd:f box containing protein	0.0049	0.045	0.0557
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0087	0.0931	0.1359
Mycobacterium ulcerans	extragenic suppressor protein SuhB	0.003	0.0205	0.0299
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0087	0.0931	0.1187
Trypanosoma cruzi	tyrosyl-DNA Phosphodiesterase (Tdp1), putative	0.0064	0.064	1
Brugia malayi	AF-10 protein	0.0035	0.0261	0.0382
Echinococcus multilocularis	PHD finger protein rhinoceros	0.0106	0.1167	0.1387
Trypanosoma cruzi	trypanothione reductase, putative	0.0046	0.0413	0.6298
Onchocerca volvulus		0.0145	0.1667	0.1972
Mycobacterium tuberculosis	Inositol-1-monophosphatase SuhB	0.0027	0.0165	0.0232
Brugia malayi	jmjC domain containing protein	0.0049	0.045	0.0658
Echinococcus multilocularis	atpase aaa+ type core atpase aaa type core	0.0663	0.8249	1
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0089	0.0956	0.1554
Wolbachia endosymbiont of Brugia malayi	N-acetylglucosamine-1-phosphate uridyltransferase	0.0486	0.6007	1
Onchocerca volvulus	Huntingtin homolog	0.01	0.1095	0.1225
Brugia malayi	hypothetical protein	0.0035	0.0271	0.0396
Loa Loa (eye worm)	jmjC domain-containing protein	0.0049	0.045	0.0657
Echinococcus granulosus	Transcription factor JmjC domain containing protein	0.0404	0.4958	0.6475
Plasmodium vivax	hypothetical protein, conserved	0.0035	0.0261	0.206
Treponema pallidum	licC protein (licC)	0.0089	0.0956	0.0932
Mycobacterium tuberculosis	NAD(P)H quinone reductase LpdA	0.0118	0.1321	0.2164
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0801	1	1
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0087	0.0931	0.11
Plasmodium falciparum	phd finger protein, putative	0.0106	0.1167	1
Loa Loa (eye worm)	hypothetical protein	0.006	0.0586	0.0855
Schistosoma mansoni	inositol monophosphatase	0.003	0.0205	0.0235
Trichomonas vaginalis	conserved hypothetical protein	0.0027	0.0164	0.0138
Brugia malayi	PHD-finger family protein	0.0106	0.1167	0.1705
Schistosoma mansoni	hypothetical protein	0.0615	0.7642	1
Toxoplasma gondii	WD domain, G-beta repeat-containing protein	0.0035	0.0261	0.206
Trypanosoma brucei	inositol-1(or 4)-monophosphatase 1, putative	0.003	0.0205	0.2918
Plasmodium falciparum	glutathione reductase	0.0046	0.0413	0.3387
Brugia malayi	hypothetical protein	0.01	0.1095	0.1599
Schistosoma mansoni	hypothetical protein	0.0028	0.0175	0.0196
Mycobacterium tuberculosis	Probable NADH dehydrogenase Ndh	0.0106	0.117	0.1912
Schistosoma mansoni	protein phosphatase 2C	0.0049	0.045	0.0557
Loa Loa (eye worm)	hypothetical protein	0.0145	0.1667	0.2434
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	0.0801	1	1
Trypanosoma brucei	tyrosyl-DNA Phosphodiesterase (Tdp1), putative	0.0064	0.064	1
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0088	0.094	0.1372
Schistosoma mansoni	phosphatidylserine receptor	0.0049	0.045	0.0557
Trichomonas vaginalis	inositol monophosphatase, putative	0.003	0.0205	0.0179
Loa Loa (eye worm)	hypothetical protein	0.0106	0.1167	0.1704
Plasmodium vivax	thioredoxin reductase, putative	0.0046	0.0413	0.3387
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0801	1	1
Wolbachia endosymbiont of Brugia malayi	fructose-1,6-bisphosphatase	0.003	0.0205	0.0299
Echinococcus granulosus	GPCR family 2	0.0028	0.0175	0.0196
Brugia malayi	jmjC domain containing protein	0.0049	0.045	0.0658
Trypanosoma brucei	trypanothione reductase	0.0046	0.0413	0.6298
Loa Loa (eye worm)	inositol-1	0.003	0.0205	0.0299
Brugia malayi	Pre-SET motif family protein	0.0079	0.0829	0.1211
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0028	0.0175	0.0255
Schistosoma mansoni	hypothetical protein	0.006	0.0586	0.0735
Toxoplasma gondii	PHD-finger domain-containing protein	0.0106	0.1167	1
Mycobacterium ulcerans	bifunctional N-acetylglucosamine-1-phosphate uridyltransferase/glucosamine-1-phosphate acetyltransferase	0.0486	0.6007	1
Giardia lamblia	PHD finger protein 15	0.0106	0.1167	0.1144
Echinococcus granulosus	tyrosyl DNA phosphodiesterase 1	0.0064	0.064	0.0805
Loa Loa (eye worm)	hypothetical protein	0.0049	0.045	0.0657
Toxoplasma gondii	inositol(myo)-1(or 4)-monophosphatase 2, putative	0.003	0.0205	0.1569
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0801	1	1
Plasmodium vivax	JmjC domain containing protein	0.0049	0.045	0.3716
Mycobacterium leprae	DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE	0.0118	0.1321	0.1978
Onchocerca volvulus		0.0629	0.7818	1
Mycobacterium leprae	Probable fructose bisphosphate aldolase Fba	0.0391	0.4794	0.7924
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0087	0.0931	0.1187
Mycobacterium tuberculosis	Probable dehydrogenase	0.0106	0.117	0.1912
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0026	0.0156	0.0227
Trichomonas vaginalis	conserved hypothetical protein	0.0038	0.0306	0.028
Loa Loa (eye worm)	jmjC domain-containing protein	0.0185	0.2179	0.3182
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0079	0.0829	0.0976
Plasmodium falciparum	thioredoxin reductase	0.0046	0.0413	0.3387
Schistosoma mansoni	hypothetical protein	0.0035	0.0271	0.0322
Trypanosoma cruzi	tyrosyl-DNA Phosphodiesterase (Tdp1), putative	0.0064	0.064	1
Echinococcus granulosus	chromobox protein 1	0.0068	0.0685	0.0865
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0035	0.0271	0.0298
Onchocerca volvulus		0.003	0.0201	0.0059
Brugia malayi	intermediate filament protein	0.0026	0.0156	0.0228
Mycobacterium ulcerans	hypothetical protein	0.0089	0.0956	0.1554
Schistosoma mansoni	jumonji domain containing protein	0.0049	0.045	0.0557
Schistosoma mansoni	ubiquitously transcribed sex (X/Y) chromosome tetratricopeptide repeat protein-related	0.0049	0.045	0.0557
Toxoplasma gondii	PHD-finger domain-containing protein	0.0035	0.0261	0.206
Schistosoma mansoni	hypothetical protein	0.0106	0.1167	0.1498
Brugia malayi	cytoplasmic intermediate filament protein	0.0014	0.0001	0.0001
Onchocerca volvulus	Alhambra homolog	0.0106	0.1167	0.132
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0087	0.0931	0.1358
Brugia malayi	N-terminal motif family protein	0.0148	0.1698	0.248
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0088	0.094	0.1372
Mycobacterium tuberculosis	Probable membrane NADH dehydrogenase NdhA	0.0106	0.117	0.1912
Brugia malayi	jmjC domain containing protein	0.0185	0.2179	0.3183
Leishmania major	trypanothione reductase	0.0046	0.0413	0.6298
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0185	0.2179	0.2827
Echinococcus granulosus	lamin dm0	0.0026	0.0156	0.017
Mycobacterium tuberculosis	Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras	0.0118	0.1321	0.2164
Trichomonas vaginalis	conserved hypothetical protein	0.0038	0.0306	0.028
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0089	0.0956	0.1554
Schistosoma mansoni	transcription factor LCR-F1	0.0035	0.0271	0.0322
Schistosoma mansoni	intermediate filament proteins	0.0026	0.0156	0.017
Mycobacterium tuberculosis	NADPH-dependent mycothiol reductase Mtr	0.0046	0.0413	0.0646
Brugia malayi	jmjC domain containing protein	0.0404	0.4958	0.724
Chlamydia trachomatis	dihydrolipoyl dehydrogenase	0.0016	0.0026	0.5
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0028	0.0175	0.0196
Mycobacterium tuberculosis	Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB	0.0106	0.117	0.1912
Schistosoma mansoni	hypothetical protein	0.0028	0.0175	0.0196
Loa Loa (eye worm)	hypothetical protein	0.0088	0.094	0.1371
Trypanosoma cruzi	myo-inositol-1(or 4)-monophosphatase 1, putative	0.003	0.0205	0.2918
Toxoplasma gondii	PHD-finger domain-containing protein	0.0106	0.1167	1
Loa Loa (eye worm)	heterochromatin protein 1	0.0068	0.0685	0.1
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.0076	0.0792	0.1005
Schistosoma mansoni	hypothetical protein	0.0035	0.0261	0.0308
Onchocerca volvulus	Huntingtin homolog	0.01	0.1095	0.1225
Plasmodium vivax	hypothetical protein, conserved	0.0106	0.1167	1
Echinococcus multilocularis	inositol monophosphatase 1	0.003	0.0205	0.0218
Loa Loa (eye worm)	hypothetical protein	0.0441	0.5432	0.7933
Entamoeba histolytica	hypothetical protein	0.0035	0.0271	0.0067
Trichomonas vaginalis	chromobox protein, putative	0.0068	0.0685	0.0661
Echinococcus multilocularis	lysine specific demethylase 6a	0.0049	0.045	0.0515
Echinococcus multilocularis	JmjC domain containing protein 4	0.0049	0.045	0.0515
Onchocerca volvulus	Heterochromatin protein 1 homolog	0.0041	0.0342	0.0244
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0553	0.6847	1
Leishmania major	tyrosyl-DNA phosphodiesterase 1	0.0064	0.064	1
Echinococcus granulosus	lamin	0.0026	0.0156	0.017
Schistosoma mansoni	chromobox protein	0.0068	0.0685	0.0865
Echinococcus multilocularis	Jumonji, AT rich interactive domain 1B	0.0049	0.045	0.0515
Brugia malayi	Latrophilin receptor protein 2	0.0028	0.0175	0.0256
Trypanosoma cruzi	JmjC domain, hydroxylase, putative	0.0049	0.045	0.691
Loa Loa (eye worm)	jmjC domain-containing protein	0.0049	0.045	0.0657
Trichomonas vaginalis	myo inositol monophosphatase, putative	0.003	0.0205	0.0179
Echinococcus granulosus	jumonji domain containing 1A	0.0049	0.045	0.0557
Brugia malayi	glutathione reductase	0.0046	0.0413	0.0603
Entamoeba histolytica	hypothetical protein	0.0035	0.0271	0.0067
Schistosoma mansoni	hypothetical protein	0.009	0.0966	0.1234
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0801	1	1
Echinococcus multilocularis	peregrin	0.0106	0.1167	0.1387
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0801	1	1

Activities

Activity type	Activity value	Assay description	Source	Reference
Activity (functional)		Agonist activity at human CRTH2 receptor expressed in HEK cells assessed as forskolin-induced cAMP formation preincubated for 10 mins followed by forskolin challenge measured after 10 to 60 mins by ELISA assay	ChEMBL.	24556380
Ki (binding)	= 2 nM	Antagonist activity at human CRTH2 receptor expressed in CHO-1 cells assessed as inhibition of PGD2-induced Ca2+ flux preincubated for 30 mins followed by PGD2 challenge measured after 60 mins by chemiluminescence assay	ChEMBL.	24556380

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: CHEMBL3125342

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1823377