TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 432.902 | Formula: C24H21ClN4O2
H donors: 1 H acceptors: 3 LogP: 4.28 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: Cc1ccc(cc1c1cc2cnn(c2n(c1=O)C)c1ccccc1Cl)C(=O)NC1CC1
InChi: 1S/C24H21ClN4O2/c1-14-7-8-15(22(30)27-17-9-10-17)11-18(14)19-12-16-13-26-29(23(16)28(2)24(19)31)21-6-4-3-5-20(21)25/h3-8,11-13,17H,9-10H2,1-2H3,(H,27,30)
InChiKey: TZXZEMSLLCXPNF-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
Homo sapiens	mitogen-activated protein kinase 14	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Trypanosoma cruzi	mitogen-activated protein kinase 3, putative	Get druggable targets OG5_128610	All targets in OG5_128610
Echinococcus multilocularis	mitogen activated protein kinase 11	Get druggable targets OG5_128610	All targets in OG5_128610
Leishmania donovani	mitogen-activated protein kinase 3, putative	Get druggable targets OG5_128610	All targets in OG5_128610
Trypanosoma cruzi	mitogen-activated protein kinase 3, putative	Get druggable targets OG5_128610	All targets in OG5_128610
Trypanosoma brucei gambiense	mitogen-activated protein kinase 3, putative	Get druggable targets OG5_128610	All targets in OG5_128610
Echinococcus granulosus	mitogen activated protein kinase 14	Get druggable targets OG5_128610	All targets in OG5_128610
Leishmania infantum	mitogen-activated protein kinase 3, putative,map kinase 3, putative	Get druggable targets OG5_128610	All targets in OG5_128610
Leishmania braziliensis	mitogen-activated protein kinase 3, putative,map kinase 3, putative	Get druggable targets OG5_128610	All targets in OG5_128610
Echinococcus multilocularis	mitogen activated protein kinase 11	Get druggable targets OG5_128610	All targets in OG5_128610
Echinococcus granulosus	mitogen activated protein kinase 11	Get druggable targets OG5_128610	All targets in OG5_128610
Leishmania mexicana	mitogen-activated protein kinase 3, putative,map kinase 3, putative	Get druggable targets OG5_128610	All targets in OG5_128610
Candida albicans	MAP kinase involved in osmoregulation	Get druggable targets OG5_128610	All targets in OG5_128610
Loa Loa (eye worm)	CMGC/MAPK/P38 protein kinase	Get druggable targets OG5_128610	All targets in OG5_128610
Leishmania major	mitogen-activated protein kinase 3, putative,map kinase 3, putative	Get druggable targets OG5_128610	All targets in OG5_128610
Schistosoma japonicum	ko:K04441 p38 MAP kinase, putative	Get druggable targets OG5_128610	All targets in OG5_128610
Echinococcus multilocularis	mitogen activated protein kinase 14	Get druggable targets OG5_128610	All targets in OG5_128610
Trypanosoma congolense	mitogen-activated protein kinase 3, putative	Get druggable targets OG5_128610	All targets in OG5_128610
Candida albicans	MAP kinase involved in osmoregulation	Get druggable targets OG5_128610	All targets in OG5_128610
Echinococcus multilocularis	mitogen activated protein kinase 14	Get druggable targets OG5_128610	All targets in OG5_128610
Brugia malayi	P38 map kinase family protein 2	Get druggable targets OG5_128610	All targets in OG5_128610
Trypanosoma brucei	mitogen-activated protein kinase 3, putative	Get druggable targets OG5_128610	All targets in OG5_128610

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Trypanosoma brucei	mitogen-activated protein kinase 5	mitogen-activated protein kinase 14	360 aa	336 aa	33.3 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0162	0.0173
Echinococcus granulosus	importin subunit beta 1	0.003	0.0256	0.0256
Schistosoma mansoni	rab6-interacting	0.0042	0.0502	0.0502
Trichomonas vaginalis	inositol monophosphatase, putative	0.0039	0.0449	0.3188
Brugia malayi	MH2 domain containing protein	0.0246	0.4561	0.4865
Schistosoma mansoni	hypothetical protein	0.0045	0.0556	0.0556
Echinococcus granulosus	intermediate filament protein	0.0029	0.0235	0.0235
Brugia malayi	nuclear receptor NHR-88	0.0053	0.0718	0.0765
Echinococcus granulosus	alkaline phosphatase	0.0167	0.299	0.299
Echinococcus multilocularis	chromobox protein 1	0.0072	0.1099	0.1099
Schistosoma mansoni	thyroid hormone receptor	0.0053	0.0718	0.0718
Echinococcus granulosus	inositol monophosphatase 1	0.0039	0.0449	0.0449
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0222	0.0237
Loa Loa (eye worm)	MH2 domain-containing protein	0.0246	0.4561	0.4865
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0162	0.0173
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0037	0.0401	0.0401
Mycobacterium tuberculosis	Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2)	0.0057	0.079	0.2317
Echinococcus multilocularis	geminin	0.052	1	1
Echinococcus multilocularis	lipoxygenase domain containing protein	0.0042	0.0502	0.0502
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0025	0.0162	0.0162
Leishmania major	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0039	0.0449	0.1197
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0037	0.0401	0.0401
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0235	0.0251
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0053	0.0718	0.0718
Brugia malayi	Intermediate filament tail domain containing protein	0.0029	0.0235	0.0251
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0053	0.0718	0.0765
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0053	0.0718	0.0718
Brugia malayi	Nuclear hormone receptor-like 1	0.0028	0.0222	0.0237
Schistosoma mansoni	chromobox protein	0.0072	0.1099	0.1099
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0053	0.0718	0.0765
Loa Loa (eye worm)	hypothetical protein	0.0153	0.2714	0.2895
Echinococcus granulosus	peptidase Clp S14 family	0.0057	0.079	0.079
Echinococcus granulosus	intestinal type alkaline phosphatase	0.0167	0.299	0.299
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0327	0.0349
Brugia malayi	steroid hormone receptor	0.0053	0.0718	0.0765
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0053	0.0718	0.0765
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0033	0.0327	0.0349
Brugia malayi	hypothetical protein	0.0042	0.0502	0.0535
Echinococcus multilocularis	nuclear receptor subfamily 1 group D	0.0028	0.0222	0.0222
Schistosoma mansoni	peptidase Clp (S14 family)	0.0086	0.138	0.138
Schistosoma mansoni	hepatocyte nuclear factor 4-alpha (hnf-4-alpha)	0.0025	0.0162	0.0162
Loa Loa (eye worm)	hypothetical protein	0.0093	0.1504	0.1605
Schistosoma mansoni	intermediate filament proteins	0.0029	0.0235	0.0235
Onchocerca volvulus	Protein ultraspiracle homolog	0.0053	0.0718	0.0603
Loa Loa (eye worm)	intermediate filament protein	0.0029	0.0235	0.0251
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0053	0.0718	0.0765
Echinococcus granulosus	histone lysine methyltransferase setb	0.0037	0.0401	0.0401
Schistosoma mansoni	lozenge	0.0061	0.0884	0.0884
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0053	0.0718	0.0718
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0053	0.0718	0.0718
Echinococcus granulosus	intestinal type alkaline phosphatase 1	0.0167	0.299	0.299
Trichomonas vaginalis	conserved hypothetical protein	0.0029	0.0235	0.0949
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0162	0.0173
Plasmodium falciparum	ATP-dependent Clp protease proteolytic subunit	0.0086	0.138	1
Schistosoma mansoni	hypothetical protein	0.0033	0.0327	0.0327
Loa Loa (eye worm)	hypothetical protein	0.0086	0.138	0.1473
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0105	0.1755	0.1873
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0053	0.0718	0.0765
Onchocerca volvulus		0.0032	0.0296	0.0145
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0162	0.0173
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0033	0.0327	0.0327
Echinococcus granulosus	ATP dependent Clp protease proteolytic subunit	0.0086	0.138	0.138
Echinococcus granulosus	nuclear receptor subfamily 4 group A	0.0025	0.0162	0.0162
Trypanosoma cruzi	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0039	0.0449	0.1197
Plasmodium vivax	multidomain scavenger receptor, putative	0.0042	0.0502	0.2185
Brugia malayi	Heterochromatin protein 1	0.0072	0.1099	0.1172
Brugia malayi	Bromodomain containing protein	0.0163	0.2898	0.3092
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0053	0.0718	0.0718
Loa Loa (eye worm)	CMGC/MAPK/P38 protein kinase	0.0152	0.2687	0.2866
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0053	0.0718	0.0718
Schistosoma mansoni	hypothetical protein	0.052	1	1
Brugia malayi	nuclear hormone receptor	0.0053	0.0718	0.0765
Schistosoma mansoni	nuclear receptor	0.0025	0.0162	0.0162
Schistosoma mansoni	thyroid hormone receptor	0.0053	0.0718	0.0718
Brugia malayi	nuclear hormone receptor family member nhr-6	0.0025	0.0162	0.0173
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0053	0.0718	0.0765
Treponema pallidum	ATP-dependent Clp protease proteolytic subunit	0.0086	0.138	1
Schistosoma mansoni	transcription factor LCR-F1	0.0075	0.1161	0.1161
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0053	0.0718	0.0718
Loa Loa (eye worm)	hypothetical protein	0.0053	0.0718	0.0765
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0053	0.0718	0.0718
Echinococcus multilocularis	lamin	0.0029	0.0235	0.0235
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0053	0.0718	0.0765
Schistosoma mansoni	loxhd1	0.0042	0.0502	0.0502
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0127	0.2193	1
Brugia malayi	ecdysteroid receptor	0.0053	0.0718	0.0765
Echinococcus granulosus	fetal alzheimer antigen falz	0.0049	0.0638	0.0638
Loa Loa (eye worm)	hypothetical protein	0.0489	0.9374	1
Plasmodium vivax	ATP-dependent Clp protease proteolytic subunit, putative	0.0086	0.138	1
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0502	0.0535
Brugia malayi	hypothetical protein	0.0028	0.0222	0.0237
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0053	0.0718	0.0718
Schistosoma mansoni	hypothetical protein	0.0317	0.5958	0.5958
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0222	0.0237
Echinococcus multilocularis	neuropeptide s receptor	0.0476	0.9118	0.9118
Echinococcus granulosus	alkaline phosphatase intestinal gene 2	0.0167	0.299	0.299
Wolbachia endosymbiont of Brugia malayi	ATP-dependent Clp protease proteolytic subunit	0.0086	0.138	1
Loa Loa (eye worm)	PHD-finger family protein	0.0045	0.0556	0.0593
Loa Loa (eye worm)	hypothetical protein	0.0053	0.0718	0.0765
Schistosoma mansoni	alkaline phosphatase	0.0167	0.299	0.299
Loa Loa (eye worm)	hypothetical protein	0.004	0.0469	0.0501
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0053	0.0718	0.0718
Trypanosoma cruzi	ISWI complex protein	0.0033	0.0326	0.0713
Schistosoma mansoni	nuclear hormone receptor	0.0053	0.0718	0.0718
Onchocerca volvulus	Bile acid receptor homolog	0.0053	0.0718	0.0603
Plasmodium vivax	ATP-dependent Clp protease proteolytic subunit, putative	0.003	0.0257	0.001
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0162	0.0173
Echinococcus multilocularis	Protein lozenge	0.0061	0.0884	0.0884
Entamoeba histolytica	hypothetical protein	0.0075	0.1161	1
Loa Loa (eye worm)	hypothetical protein	0.0072	0.1094	0.1168
Loa Loa (eye worm)	hypothetical protein	0.0053	0.0718	0.0765
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0105	0.1755	0.1873
Loa Loa (eye worm)	DR-78	0.0025	0.0162	0.0173
Mycobacterium leprae	possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ).	0.0035	0.0367	0.0976
Echinococcus multilocularis	importin subunit beta 1	0.003	0.0256	0.0256
Brugia malayi	Steroid receptor seven-up type 2	0.0053	0.0718	0.0765
Chlamydia trachomatis	ATP-dependent Clp protease proteolytic subunit	0.0086	0.138	0.5
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0053	0.0718	0.0718
Schistosoma mansoni	retinoic acid receptor RXR	0.0053	0.0718	0.0718
Echinococcus multilocularis	methyl CpG binding domain protein 2	0.0037	0.0401	0.0401
Schistosoma mansoni	polycystin 1-related	0.0042	0.0502	0.0502
Loa Loa (eye worm)	hypothetical protein	0.0083	0.132	0.1408
Echinococcus granulosus	chromobox protein 1	0.0072	0.1099	0.1099
Brugia malayi	ecdysone receptor	0.0025	0.0162	0.0173
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0053	0.0718	0.0718
Onchocerca volvulus		0.0042	0.0502	0.0368
Echinococcus granulosus	mitogen activated protein kinase 14	0.0152	0.2687	0.2687
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0075	0.1161	0.1161
Onchocerca volvulus		0.0029	0.0235	0.0079
Brugia malayi	nuclear hormone receptor	0.0025	0.0162	0.0173
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0053	0.0718	0.0718
Brugia malayi	P38 map kinase family protein 2	0.0152	0.2687	0.2866
Schistosoma mansoni	methyl-cpg binding protein mbd	0.0037	0.0401	0.0401
Loa Loa (eye worm)	nuclear hormone receptor-like 1	0.0028	0.0222	0.0237
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0075	0.1161	0.1161
Schistosoma mansoni	inositol monophosphatase	0.0039	0.0449	0.0449
Loa Loa (eye worm)	hypothetical protein	0.0489	0.9374	1
Schistosoma mansoni	rab6-interacting	0.0042	0.0502	0.0502
Loa Loa (eye worm)	hypothetical protein	0.0088	0.1422	0.1517
Trypanosoma cruzi	mitogen-activated protein kinase 3, putative	0.0152	0.2687	1
Echinococcus multilocularis	GPCR, family 2	0.0033	0.0327	0.0327
Brugia malayi	hypothetical protein	0.0075	0.1161	0.1238
Brugia malayi	Bromodomain containing protein	0.0083	0.1317	0.1405
Echinococcus granulosus	GPCR family 2	0.0033	0.0327	0.0327
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0033	0.0327	0.0327
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0127	0.2193	1
Schistosoma mansoni	ecdysone-induced protein 78c (dr-78)	0.0028	0.0222	0.0222
Toxoplasma gondii	hypothetical protein	0.003	0.0257	0.0006
Echinococcus multilocularis	intestinal type alkaline phosphatase	0.0167	0.299	0.299
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0053	0.0718	0.0718
Brugia malayi	Nuclear hormone receptor E75	0.0025	0.0162	0.0173
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0162	0.0173
Echinococcus multilocularis	zinc finger protein	0.0042	0.051	0.051
Mycobacterium tuberculosis	Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP)	0.0057	0.079	0.2317
Trypanosoma cruzi	mitogen-activated protein kinase 3, putative	0.0152	0.2687	1
Schistosoma mansoni	hypothetical protein	0.0033	0.0327	0.0327
Brugia malayi	nuclear receptor NHR-88	0.0025	0.0162	0.0173
Brugia malayi	hypothetical protein	0.0025	0.0162	0.0173
Schistosoma mansoni	aldehyde dehydrogenase	0.0127	0.2193	0.2193
Echinococcus granulosus	lipoxygenase domain containing protein	0.0042	0.0502	0.0502
Echinococcus multilocularis	nuclear receptor nhr 48	0.0025	0.0162	0.0162
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0033	0.0327	0.0327
Echinococcus multilocularis	intestinal type alkaline phosphatase 1	0.0167	0.299	0.299
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0053	0.0718	0.0765
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0025	0.0162	0.0162
Echinococcus granulosus	neuropeptide s receptor	0.0476	0.9118	0.9118
Toxoplasma gondii	ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein	0.0086	0.138	0.5804
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0053	0.0718	0.0765
Echinococcus multilocularis	lipoxygenase domain containing protein	0.0042	0.0502	0.0502
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0105	0.1755	0.1873
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0053	0.0718	0.0765
Schistosoma mansoni	methyl-cpg binding protein mbd	0.0037	0.0401	0.0401
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0025	0.0162	0.0162
Brugia malayi	RNA, U transporter 1	0.0084	0.1342	0.1432
Loa Loa (eye worm)	hypothetical protein	0.003	0.0256	0.0273
Loa Loa (eye worm)	hypothetical protein	0.0053	0.0718	0.0765
Echinococcus granulosus	FTZ F1 alpha	0.0053	0.0718	0.0718
Echinococcus granulosus	bromodomain adjacent to zinc finger domain	0.013	0.2239	0.2239
Echinococcus granulosus	Polycystic kidney disease protein	0.0042	0.0502	0.0502
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0162	0.0173
Onchocerca volvulus		0.0489	0.9374	1
Loa Loa (eye worm)	transcription factor SMAD2	0.0246	0.4561	0.4865
Echinococcus granulosus	aldehyde dehydrogenase mitochondrial	0.0127	0.2193	0.2193
Trypanosoma cruzi	ISWI complex protein	0.0033	0.0326	0.0713
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0033	0.0327	0.0327
Entamoeba histolytica	hypothetical protein	0.0075	0.1161	1
Brugia malayi	Doublecortin family protein	0.0042	0.0502	0.0535
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0053	0.0718	0.0718
Onchocerca volvulus		0.0053	0.0718	0.0603
Echinococcus granulosus	snurportin 1	0.0317	0.5958	0.5958
Echinococcus granulosus	chromobox protein 1	0.0072	0.1099	0.1099
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0053	0.0718	0.0765
Trypanosoma cruzi	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0039	0.0449	0.1197
Brugia malayi	orphan nuclear receptor NR2E1	0.0025	0.0162	0.0173
Schistosoma mansoni	nuclear hormone receptor	0.0025	0.0162	0.0162
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0053	0.0718	0.0718
Brugia malayi	Latrophilin receptor protein 2	0.0033	0.0327	0.0349
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0222	0.0237
Echinococcus multilocularis	mitogen activated protein kinase 11	0.0152	0.2687	0.2687
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0053	0.0718	0.0765
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0053	0.0718	0.0765
Brugia malayi	Nuclear hormone receptor-like 1	0.0028	0.0222	0.0237
Onchocerca volvulus	Heterochromatin protein 1 homolog	0.004	0.0469	0.0333
Trypanosoma brucei	mitogen-activated protein kinase 3, putative	0.0152	0.2687	1
Brugia malayi	nuclear receptor NHR-67	0.0025	0.0162	0.0173
Loa Loa (eye worm)	nuclear hormone receptor	0.0025	0.0162	0.0173
Trichomonas vaginalis	myo inositol monophosphatase, putative	0.0039	0.0449	0.3188
Echinococcus granulosus	nuclear receptor subfamily 1 group D	0.0028	0.0222	0.0222
Loa Loa (eye worm)	hypothetical protein	0.0053	0.0718	0.0765
Loa Loa (eye worm)	runx1	0.0061	0.0884	0.0943
Schistosoma mansoni	nuclear receptor nhr-48	0.0025	0.0162	0.0162
Brugia malayi	PHD-finger family protein	0.0054	0.074	0.0789
Toxoplasma gondii	inositol(myo)-1(or 4)-monophosphatase 2, putative	0.0039	0.0449	0.0995
Echinococcus multilocularis	bromodomain adjacent to zinc finger domain	0.013	0.2239	0.2239
Brugia malayi	Nuclear hormone receptor E75	0.0025	0.0162	0.0173
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0025	0.0162	0.0162
Echinococcus granulosus	lamin	0.0029	0.0235	0.0235
Brugia malayi	intermediate filament protein	0.0029	0.0235	0.0251
Loa Loa (eye worm)	inositol-1	0.0039	0.0449	0.0479
Trichomonas vaginalis	chromobox protein, putative	0.0072	0.1099	1
Schistosoma mansoni	hypothetical protein	0.0075	0.1161	0.1161
Mycobacterium ulcerans	ATP-dependent Clp protease proteolytic subunit	0.0086	0.138	0.5341
Brugia malayi	hypothetical protein	0.0028	0.0222	0.0237
Loa Loa (eye worm)	nuclear receptor nhr-7B	0.0025	0.0162	0.0173
Loa Loa (eye worm)	hypothetical protein	0.0105	0.1755	0.1873
Schistosoma mansoni	hypothetical protein	0.0042	0.0502	0.0502
Entamoeba histolytica	myo-inositol monophosphatase, putative	0.0039	0.0449	0.2993
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0053	0.0718	0.0765
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0053	0.0718	0.0718
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0053	0.0718	0.0718
Mycobacterium leprae	PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP)	0.0057	0.079	0.4744
Trichomonas vaginalis	chromobox protein, putative	0.0043	0.053	0.4044
Brugia malayi	Inositol-1	0.0039	0.0449	0.0479
Schistosoma mansoni	nuclear hormone receptor	0.0025	0.0162	0.0162
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0028	0.0222	0.0222
Echinococcus multilocularis	FTZ F1 alpha	0.0053	0.0718	0.0718
Brugia malayi	photoreceptor-specific nuclear receptor	0.0053	0.0718	0.0765
Echinococcus multilocularis	aldehyde dehydrogenase, mitochondrial	0.0127	0.2193	0.2193
Schistosoma mansoni	hypothetical protein	0.0033	0.0327	0.0327
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0502	0.0535
Brugia malayi	hypothetical protein	0.0025	0.0162	0.0173
Schistosoma mansoni	lamin	0.0029	0.0235	0.0235
Echinococcus multilocularis	RUN	0.0042	0.0502	0.0502
Echinococcus multilocularis	snurportin 1	0.0317	0.5958	0.5958
Onchocerca volvulus	Heterochromatin protein 1 homolog	0.0043	0.053	0.04
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0053	0.0718	0.0765
Echinococcus multilocularis	mitogen activated protein kinase 14	0.0152	0.2687	0.2687
Brugia malayi	hypothetical protein	0.0489	0.9374	1
Echinococcus granulosus	arachidonate 5 lipoxygenase	0.0252	0.4662	0.4662
Toxoplasma gondii	ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein	0.0086	0.138	0.5804
Trypanosoma brucei	inositol-1(or 4)-monophosphatase 1, putative	0.0039	0.0449	0.0793
Onchocerca volvulus		0.0029	0.0235	0.0079
Loa Loa (eye worm)	hypothetical protein	0.0053	0.0718	0.0765
Echinococcus granulosus	thyroid hormone receptor alpha	0.0025	0.0162	0.0162
Toxoplasma gondii	aldehyde dehydrogenase	0.0127	0.2193	1
Loa Loa (eye worm)	heterochromatin protein 1	0.0072	0.1099	0.1172
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0053	0.0718	0.0718
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0296	0.0316
Schistosoma mansoni	lipoxygenase	0.0252	0.4662	0.4662
Brugia malayi	Importin beta-1 subunit	0.003	0.0256	0.0273
Echinococcus granulosus	mitogen activated protein kinase 11	0.0152	0.2687	0.2687
Leishmania major	aldehyde dehydrogenase, mitochondrial precursor	0.0127	0.2193	0.8059
Onchocerca volvulus		0.0042	0.0502	0.0368
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0037	0.0401	0.0401
Echinococcus multilocularis	bromodomain adjacent to zinc finger domain	0.0078	0.1215	0.1215
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0025	0.0162	0.0162
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0222	0.0237
Loa Loa (eye worm)	hypothetical protein	0.0053	0.0718	0.0765
Echinococcus multilocularis	nuclear receptor subfamily 4 group A	0.0025	0.0162	0.0162
Brugia malayi	nuclear receptor subfamily 1, group D, member 1, putative	0.0025	0.0162	0.0173
Echinococcus multilocularis	retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha	0.0025	0.0162	0.0162
Schistosoma mansoni	inositol monophosphatase	0.0039	0.0449	0.0449
Schistosoma mansoni	chromobox protein	0.0072	0.1099	0.1099
Schistosoma mansoni	alkaline phosphatase	0.0167	0.299	0.299
Trichomonas vaginalis	chromobox protein, putative	0.0043	0.053	0.4044
Echinococcus multilocularis	alkaline phosphatase	0.0167	0.299	0.299
Echinococcus multilocularis	fetal alzheimer antigen, falz	0.0049	0.0638	0.0638
Brugia malayi	tailless protein	0.0025	0.0162	0.0173
Schistosoma mansoni	acetyl-CoA C-acetyltransferase	0.0049	0.0638	0.0638
Leishmania major	hypothetical protein, conserved	0.0033	0.0326	0.0713
Schistosoma mansoni	hypothetical protein	0.0033	0.0327	0.0327
Schistosoma mansoni	RAR-like nuclear receptor	0.0053	0.0718	0.0718
Echinococcus granulosus	methyl CpG binding domain protein 2	0.0037	0.0401	0.0401
Brugia malayi	nuclear hormone receptor family member odr-7	0.0025	0.0162	0.0173
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0162	0.0173
Echinococcus granulosus	bromodomain adjacent to zinc finger domain	0.0078	0.1215	0.1215
Plasmodium falciparum	ATP-dependent Clp protease proteolytic subunit	0.003	0.0257	0.001
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0401	0.0428
Echinococcus multilocularis	peptidase Clp (S14 family)	0.0057	0.079	0.079
Schistosoma mansoni	zinc finger protein	0.0042	0.051	0.051
Echinococcus multilocularis	chromobox protein 1	0.0072	0.1099	0.1099
Loa Loa (eye worm)	nuclear receptor NHR-67	0.0025	0.0162	0.0173
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0053	0.0718	0.0718
Trichomonas vaginalis	chromobox protein, putative	0.0072	0.1099	1
Echinococcus multilocularis	Polycystic kidney disease protein	0.0042	0.0502	0.0502
Loa Loa (eye worm)	hypothetical protein	0.0053	0.0718	0.0765
Loa Loa (eye worm)	steroid hormone receptor	0.0053	0.0718	0.0765
Mycobacterium tuberculosis	Probable aldehyde dehydrogenase	0.0127	0.2193	1
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0127	0.2193	1
Chlamydia trachomatis	ATP-dependent Clp protease proteolytic subunit	0.0086	0.138	0.5
Echinococcus multilocularis	musashi	0.0029	0.0235	0.0235
Schistosoma mansoni	coup transcription factor	0.0053	0.0718	0.0718
Echinococcus multilocularis	mitogen activated protein kinase 11	0.0152	0.2687	0.2687
Echinococcus granulosus	neuropeptide receptor A26	0.0476	0.9118	0.9118
Schistosoma mansoni	zinc finger protein	0.0033	0.0326	0.0326
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0033	0.0327	0.0349
Trichomonas vaginalis	conserved hypothetical protein	0.004	0.0469	0.3405
Loa Loa (eye worm)	bromodomain containing protein	0.0038	0.0428	0.0456
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0162	0.0173
Schistosoma mansoni	nuclear receptor	0.0025	0.0162	0.0162
Leishmania major	mitogen-activated protein kinase 3, putative,map kinase 3, putative	0.0152	0.2687	1
Mycobacterium leprae	PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2)	0.0086	0.138	1
Trichomonas vaginalis	conserved hypothetical protein	0.004	0.0469	0.3405
Brugia malayi	Probable ClpP-like protease	0.0086	0.138	0.1473
Brugia malayi	latrophilin 2 splice variant baaae	0.0072	0.1094	0.1168
Schistosoma mansoni	importin beta-1	0.003	0.0256	0.0256
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0053	0.0718	0.0765
Echinococcus granulosus	ecdysone induced protein 78C	0.0053	0.0718	0.0718
Echinococcus multilocularis	lamin dm0	0.0029	0.0235	0.0235
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0053	0.0718	0.0765
Brugia malayi	nuclear receptor RXR	0.0028	0.0222	0.0237
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0222	0.0237
Echinococcus granulosus	zinc finger protein	0.0042	0.051	0.051
Schistosoma mansoni	zinc finger protein	0.0025	0.0162	0.0162
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0053	0.0718	0.0718
Echinococcus multilocularis	ecdysone induced protein 78C	0.0053	0.0718	0.0718
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0162	0.0173
Echinococcus multilocularis	neuropeptide receptor A26	0.0476	0.9118	0.9118
Entamoeba histolytica	hypothetical protein	0.0075	0.1161	1
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0225	0.024
Brugia malayi	hypothetical protein	0.0042	0.0502	0.0535
Brugia malayi	chromobox protein homolog 3	0.004	0.0469	0.0501
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0162	0.0173
Brugia malayi	Nuclear hormone receptor-like 1	0.0053	0.0718	0.0765
Trypanosoma brucei	ISWI complex protein	0.0033	0.0326	0.0288
Schistosoma mansoni	hypothetical protein	0.0033	0.0326	0.0326
Echinococcus multilocularis	alkaline phosphatase, intestinal, gene 2	0.0167	0.299	0.299
Echinococcus multilocularis	inositol monophosphatase 1	0.0039	0.0449	0.0449
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0162	0.0173
Echinococcus granulosus	nuclear receptor nhr 48	0.0025	0.0162	0.0162
Trichomonas vaginalis	conserved hypothetical protein	0.0029	0.0235	0.0949
Schistosoma mansoni	lamin	0.0029	0.0235	0.0235
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0162	0.0173
Mycobacterium ulcerans	ATP-dependent Clp protease proteolytic subunit	0.0086	0.138	0.5341
Echinococcus multilocularis	mitogen activated protein kinase 14	0.0152	0.2687	0.2687
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.0053	0.0718	0.0603
Loa Loa (eye worm)	nucleolar RNA-associated protein alpha	0.0317	0.5958	0.6356
Plasmodium falciparum	LCCL domain-containing protein	0.0042	0.0502	0.2185
Schistosoma mansoni	hypothetical protein	0.0072	0.1094	0.1094
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0029	0.0235	0.0251
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0053	0.0718	0.0765
Schistosoma mansoni	lipoxygenase	0.0176	0.3159	0.3159
Echinococcus granulosus	lipoxygenase domain containing protein	0.0042	0.0502	0.0502
Entamoeba histolytica	hypothetical protein	0.0075	0.1161	1
Schistosoma mansoni	aldehyde dehydrogenase	0.0127	0.2193	0.2193
Schistosoma mansoni	hypothetical protein	0.052	1	1
Loa Loa (eye worm)	doublecortin family protein	0.0042	0.0502	0.0535
Brugia malayi	nuclear receptor RXR	0.0025	0.0162	0.0173
Schistosoma mansoni	nuclear hormone receptor superfamily protein-related	0.0025	0.0162	0.0162
Echinococcus multilocularis	ATP dependent Clp protease proteolytic subunit	0.0086	0.138	0.138
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0025	0.0162	0.0162
Echinococcus granulosus	lamin dm0	0.0029	0.0235	0.0235
Echinococcus multilocularis	arachidonate 5 lipoxygenase	0.0252	0.4662	0.4662
Brugia malayi	conserved hypotetical protein	0.0025	0.0162	0.0173
Trichomonas vaginalis	myo inositol monophosphatase, putative	0.0039	0.0449	0.3188
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0053	0.0718	0.0765
Echinococcus granulosus	RUN	0.0042	0.0502	0.0502
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0053	0.0718	0.0765
Schistosoma mansoni	hypothetical protein	0.0087	0.1394	0.1394
Schistosoma mansoni	bromodomain containing protein	0.0137	0.2393	0.2393

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (functional)	= 1.1 nM	Inhibition of LPS-induced TNFalpha production in human THP1 cells after 3 hrs	ChEMBL.	20218619
IC50 (functional)	= 8.7 nM	Inhibition of IL-8 production in TNFalpha challenged human whole blood after 16 to 18 hrs	ChEMBL.	20218619
Ki (binding)	= 0.9 nM	Inhibition of human recombinant p38alpha-mediated AFT2 phosphorylation after 1 hr by HTRF assay	ChEMBL.	20218619

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Homo sapiens	ChEMBL23	20218619

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: CHEMBL1089456

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1119882