TDR Targets

Basic information

Technical information

TDR Targets ID: 831758
Name: 1-ethyl-4-[2-(4-ethylpiperazin-1-yl)-2-oxoeth yl]sulfanylquinolin-2-one
MW: 359.486 | Formula: C19H25N3O2S
H donors: 0 H acceptors: 2 LogP: 1.82 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: CCN1CCN(CC1)C(=O)CSc1cc(=O)n(c2c1cccc2)CC
InChi: 1S/C19H25N3O2S/c1-3-20-9-11-21(12-10-20)19(24)14-25-17-13-18(23)22(4-2)16-8-6-5-7-15(16)17/h5-8,13H,3-4,9-12,14H2,1-2H3
InChiKey: ZGJNZVGNDNAMJL-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

1-ethyl-4-[2-(4-ethylpiperazin-1-yl)-2-oxo-ethyl]sulfanyl-quinolin-2-one
1-ethyl-4-[[2-(4-ethyl-1-piperazinyl)-2-oxoethyl]thio]-2-quinolinone
1-ethyl-4-[[2-(4-ethylpiperazin-1-yl)-2-keto-ethyl]thio]carbostyril
MLS000520381
SMR000130792

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	ATPase family, AAA domain containing 5	Starlite/ChEMBL	No references
Rattus norvegicus	Inositol monophosphatase 1	Starlite/ChEMBL	No references
Homo sapiens	lamin A/C	Starlite/ChEMBL	No references
Homo sapiens	hydroxyprostaglandin dehydrogenase 15-(NAD)	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Echinococcus multilocularis	musashi	Get druggable targets OG5_128723	All targets in OG5_128723
Onchocerca volvulus		Get druggable targets OG5_128723	All targets in OG5_128723
Trypanosoma cruzi	myo-inositol-1(or 4)-monophosphatase 1, putative	Get druggable targets OG5_126810	All targets in OG5_126810
Onchocerca volvulus		Get druggable targets OG5_128723	All targets in OG5_128723
Trichomonas vaginalis	myo inositol monophosphatase, putative	Get druggable targets OG5_126810	All targets in OG5_126810
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_128723	All targets in OG5_128723
Echinococcus granulosus	cytoplasmic intermediate filament protein	Get druggable targets OG5_128723	All targets in OG5_128723
Leishmania donovani	myo-inositol-1(or 4)-monophosphatase 1, putative	Get druggable targets OG5_126810	All targets in OG5_126810
Neospora caninum	hypothetical protein	Get druggable targets OG5_126810	All targets in OG5_126810
Trypanosoma brucei gambiense	inositol-1(or 4)-monophosphatase 1, putative	Get druggable targets OG5_126810	All targets in OG5_126810
Trypanosoma congolense	inositol-1(or 4)-monophosphatase 1, putative	Get druggable targets OG5_126810	All targets in OG5_126810
Echinococcus multilocularis	lamin dm0	Get druggable targets OG5_128723	All targets in OG5_128723
Loa Loa (eye worm)	inositol-1	Get druggable targets OG5_126810	All targets in OG5_126810
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_128723	All targets in OG5_128723
Echinococcus multilocularis	lamin	Get druggable targets OG5_128723	All targets in OG5_128723
Schistosoma mansoni	lamin	Get druggable targets OG5_128723	All targets in OG5_128723
Leishmania infantum	myo-inositol-1(or 4)-monophosphatase 1, putative	Get druggable targets OG5_126810	All targets in OG5_126810
Schistosoma japonicum	Intermediate filament protein ifa-1, putative	Get druggable targets OG5_128723	All targets in OG5_128723
Leishmania mexicana	myo-inositol-1(or 4)-monophosphatase 1, putative	Get druggable targets OG5_126810	All targets in OG5_126810
Trichomonas vaginalis	inositol monophosphatase, putative	Get druggable targets OG5_126810	All targets in OG5_126810
Mycobacterium tuberculosis	Inositol-1-monophosphatase SuhB	Get druggable targets OG5_126810	All targets in OG5_126810
Mycobacterium ulcerans	extragenic suppressor protein SuhB	Get druggable targets OG5_126810	All targets in OG5_126810
Schistosoma japonicum	ko:K01092 myo-inositol-1(or 4)-monophosphatase [EC3.1.3.25], putative	Get druggable targets OG5_126810	All targets in OG5_126810
Brugia malayi	Inositol-1	Get druggable targets OG5_126810	All targets in OG5_126810
Schistosoma mansoni	inositol monophosphatase	Get druggable targets OG5_126810	All targets in OG5_126810
Schistosoma mansoni	lamin	Get druggable targets OG5_128723	All targets in OG5_128723
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_128723	All targets in OG5_128723
Loa Loa (eye worm)	intermediate filament protein	Get druggable targets OG5_128723	All targets in OG5_128723
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_128723	All targets in OG5_128723
Schistosoma japonicum	Lamin-C, putative	Get druggable targets OG5_128723	All targets in OG5_128723
Brugia malayi	Intermediate filament tail domain containing protein	Get druggable targets OG5_128723	All targets in OG5_128723
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	Get druggable targets OG5_128723	All targets in OG5_128723
Trypanosoma cruzi	myo-inositol-1(or 4)-monophosphatase 1, putative	Get druggable targets OG5_126810	All targets in OG5_126810
Schistosoma japonicum	expressed protein	Get druggable targets OG5_128723	All targets in OG5_128723
Echinococcus granulosus	lamin dm0	Get druggable targets OG5_128723	All targets in OG5_128723
Schistosoma mansoni	intermediate filament proteins	Get druggable targets OG5_128723	All targets in OG5_128723
Schistosoma japonicum	expressed protein	Get druggable targets OG5_128723	All targets in OG5_128723
Toxoplasma gondii	inositol(myo)-1(or 4)-monophosphatase 2, putative	Get druggable targets OG5_126810	All targets in OG5_126810
Leishmania major	myo-inositol-1(or 4)-monophosphatase 1, putative	Get druggable targets OG5_126810	All targets in OG5_126810
Schistosoma japonicum	ko:K07611 lamin, putative	Get druggable targets OG5_128723	All targets in OG5_128723
Echinococcus multilocularis	inositol monophosphatase 1	Get druggable targets OG5_126810	All targets in OG5_126810
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_128723	All targets in OG5_128723
Trichomonas vaginalis	myo inositol monophosphatase, putative	Get druggable targets OG5_126810	All targets in OG5_126810
Echinococcus multilocularis	cytoplasmic intermediate filament protein	Get druggable targets OG5_128723	All targets in OG5_128723
Trypanosoma brucei	inositol-1(or 4)-monophosphatase 1, putative	Get druggable targets OG5_126810	All targets in OG5_126810
Echinococcus multilocularis	atpase aaa+ type core atpase aaa type core	Get druggable targets OG5_139225	All targets in OG5_139225
Entamoeba histolytica	myo-inositol monophosphatase, putative	Get druggable targets OG5_126810	All targets in OG5_126810
Mycobacterium leprae	possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ).	Get druggable targets OG5_126810	All targets in OG5_126810
Schistosoma mansoni	inositol monophosphatase	Get druggable targets OG5_126810	All targets in OG5_126810
Leishmania braziliensis	myo-inositol-1(or 4)-monophosphatase 1, putative	Get druggable targets OG5_126810	All targets in OG5_126810
Echinococcus granulosus	inositol monophosphatase 1	Get druggable targets OG5_126810	All targets in OG5_126810
Echinococcus granulosus	intermediate filament protein	Get druggable targets OG5_128723	All targets in OG5_128723
Wolbachia endosymbiont of Brugia malayi	fructose-1,6-bisphosphatase	Get druggable targets OG5_126810	All targets in OG5_126810
Echinococcus granulosus	lamin	Get druggable targets OG5_128723	All targets in OG5_128723
Brugia malayi	intermediate filament protein	Get druggable targets OG5_128723	All targets in OG5_128723

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Schistosoma mansoni	pap-inositol-14-phosphatase	Inositol monophosphatase 1	277 aa	279 aa	22.9 %
Trichomonas vaginalis	diphosphonucleoside phosphohydrolase, putative	Inositol monophosphatase 1	277 aa	263 aa	21.7 %
Candida albicans	one of two closely related genes similar to S. cerevisiae MET22/HAL2 (YOL064C) bisphosphate-3'-nucleotidase, implicated in salt	Inositol monophosphatase 1	277 aa	306 aa	22.5 %
Trichomonas vaginalis	inositol monophosphatase, putative	Inositol monophosphatase 1	277 aa	268 aa	22.4 %
Dictyostelium discoideum	3',5'-bisphosphate nucleotidase	Inositol monophosphatase 1	277 aa	230 aa	25.2 %
Entamoeba histolytica	3(2),5-bisphosphate nucleotidase, putative	Inositol monophosphatase 1	277 aa	263 aa	24.0 %
Onchocerca volvulus	Putative 28S ribosomal protein S10, mitochondrial	Inositol monophosphatase 1	277 aa	271 aa	46.1 %
Brugia malayi	Inositol monophosphatase family protein	Inositol monophosphatase 1	277 aa	238 aa	21.8 %
Candida albicans	one of two closely related genes similar to S. cerevisiae MET22/HAL2 (YOL064C) bisphosphate-3'-nucleotidase, implicated in salt	Inositol monophosphatase 1	277 aa	307 aa	22.5 %
Trypanosoma congolense	inositol-1(or 4)-monophosphatase, putative	Inositol monophosphatase 1	277 aa	304 aa	28.9 %
Trypanosoma brucei gambiense	inositol-1(or 4)-monophosphatase, putative	Inositol monophosphatase 1	277 aa	309 aa	27.8 %
Loa Loa (eye worm)	hypothetical protein	Inositol monophosphatase 1	277 aa	298 aa	23.8 %
Trypanosoma cruzi	myo-inositol-1 phosphatase, putative	Inositol monophosphatase 1	277 aa	284 aa	30.6 %
Schistosoma japonicum	ko:K01082 3'(2'), 5'-bisphosphate nucleotidase [EC3.1.3.7], putative	Inositol monophosphatase 1	277 aa	275 aa	21.5 %
Trypanosoma cruzi	inositol polyphosphate 1-phosphatase, putative	Inositol monophosphatase 1	277 aa	291 aa	23.7 %
Plasmodium falciparum	steroid dehydrogenase, putative	hydroxyprostaglandin dehydrogenase 15-(NAD)	266 aa	216 aa	22.2 %
Trichomonas vaginalis	myo inositol monophosphatase, putative	Inositol monophosphatase 1	277 aa	276 aa	21.4 %
Onchocerca volvulus	Putative trans-2-enoyl-CoA reductase 1, mitochondrial	Inositol monophosphatase 1	277 aa	278 aa	23.0 %
Entamoeba histolytica	3(2),5-bisphosphate nucleotidase, putative	Inositol monophosphatase 1	277 aa	287 aa	22.3 %
Trichomonas vaginalis	inositol monophosphatase, putative	Inositol monophosphatase 1	277 aa	258 aa	21.7 %
Dictyostelium discoideum	3',5'-bisphosphate nucleotidase 1	Inositol monophosphatase 1	277 aa	275 aa	22.2 %
Trypanosoma brucei	inositol-1(or 4)-monophosphatase, putative	Inositol monophosphatase 1	277 aa	304 aa	27.3 %
Onchocerca volvulus		Inositol monophosphatase 1	277 aa	238 aa	22.7 %
Candida albicans	one of two closely related genes similar to S. cerevisiae MET22/HAL2 (YOL064C) bisphosphate-3'-nucleotidase, implicated in salt	Inositol monophosphatase 1	277 aa	300 aa	22.0 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Brugia malayi	Inositol-1	0.0045	0.03	0.1013
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0055	0.041	0.1041
Echinococcus multilocularis	lamin	0.0033	0.0175	0.0175
Mycobacterium ulcerans	extragenic suppressor protein SuhB	0.0045	0.03	0.0464
Plasmodium falciparum	acyl-CoA synthetase	0.0035	0.0203	0.042
Loa Loa (eye worm)	hypothetical protein	0.0286	0.2801	1
Echinococcus granulosus	lamin	0.0033	0.0175	0.0444
Brugia malayi	intermediate filament protein	0.0033	0.0175	0.0564
Trypanosoma cruzi	Valosin-containing protein, putative	0.0375	0.373	1
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0327	0.1166
Trichomonas vaginalis	26S protease regulatory subunit S10b, putative	0.0093	0.0807	0.195
Trypanosoma cruzi	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0045	0.03	0.0683
Trypanosoma cruzi	katanin-like protein, putative	0.002	0.0048	0.0000053311
Brugia malayi	Intermediate filament tail domain containing protein	0.0033	0.0175	0.0564
Mycobacterium ulcerans	acyl-CoA synthetase	0.0047	0.0327	0.0592
Mycobacterium ulcerans	hypothetical protein	0.0047	0.0327	0.0592
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0047	0.0327	0.0756
Mycobacterium ulcerans	acyl-CoA synthetase	0.0047	0.0327	0.0592
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0047	0.0327	0.0592
Loa Loa (eye worm)	intermediate filament protein	0.0033	0.0175	0.0624
Mycobacterium ulcerans	acyl-CoA synthetase	0.0047	0.0327	0.0592
Echinococcus granulosus	fidgetin protein 1	0.002	0.0048	0.0122
Brugia malayi	hypothetical protein	0.0286	0.2801	1
Onchocerca volvulus		0.0033	0.0175	0.0373
Schistosoma mansoni	cell division control protein 48 aaa family protein	0.0164	0.1534	0.3817
Mycobacterium tuberculosis	Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.0035	0.0203	0.0095
Onchocerca volvulus		0.0058	0.0441	0.1054
Brugia malayi	AMP-binding enzyme family protein	0.0047	0.0327	0.1109
Trypanosoma cruzi	vesicular transport protein (CDC48 homologue), putative	0.002	0.0048	0.0000053311
Trypanosoma cruzi	vacuolar transport protein 4A, putative	0.002	0.0048	0.0000053311
Trypanosoma cruzi	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0045	0.03	0.0683
Schistosoma mansoni	intermediate filament proteins	0.0033	0.0175	0.0325
Echinococcus granulosus	lamin dm0	0.0033	0.0175	0.0444
Trichomonas vaginalis	inositol monophosphatase, putative	0.0045	0.03	0.0646
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0047	0.0327	0.0756
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0175	0.0624
Plasmodium vivax	cell division cycle ATPase, putative	0.0143	0.1323	0.3176
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0203	0.0724
Trypanosoma brucei	Valosin-containing protein	0.0375	0.373	1
Brugia malayi	valosin containing protein	0.0232	0.2244	0.8
Trypanosoma cruzi	katanin, putative	0.002	0.0048	0.0000053311
Chlamydia trachomatis	acylglycerophosphoethanolamine acyltransferase	0.0035	0.0203	0.5
Trypanosoma brucei	inositol-1(or 4)-monophosphatase 1, putative	0.0045	0.03	0.0683
Entamoeba histolytica	myo-inositol monophosphatase, putative	0.0045	0.03	0.0683
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0203	0.0724
Plasmodium falciparum	cell division cycle protein 48 homologue, putative	0.0375	0.373	1
Leishmania major	4-coumarate:coa ligase-like protein	0.0047	0.0327	0.0756
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0033	0.0175	0.0624
Echinococcus multilocularis	inositol monophosphatase 1	0.0045	0.03	0.03
Leishmania major	Transitional endoplasmic reticulum ATPase, putative,valosin-containing protein homolog	0.0375	0.373	1
Trypanosoma cruzi	katanin, putative	0.002	0.0048	0.0000053311
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0055	0.041	0.1041
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0203	0.0724
Echinococcus granulosus	intermediate filament protein	0.0033	0.0175	0.0444
Entamoeba histolytica	cdc48-like protein, putative	0.0375	0.373	1
Echinococcus granulosus	vacuolar protein sorting associated protein 4A	0.002	0.0048	0.0122
Echinococcus multilocularis	musashi	0.0033	0.0175	0.0175
Echinococcus multilocularis	fidgetin protein 1	0.002	0.0048	0.0048
Brugia malayi	vps4b-prov protein	0.002	0.0048	0.0109
Onchocerca volvulus		0.0033	0.0175	0.0373
Brugia malayi	Iron-sulfur cluster assembly accessory protein	0.0058	0.0441	0.1522
Entamoeba histolytica	acyl-coA synthetase, putative	0.0047	0.0327	0.0756
Schistosoma mansoni	inositol monophosphatase	0.0045	0.03	0.0646
Echinococcus granulosus	inositol monophosphatase 1	0.0045	0.03	0.0761
Brugia malayi	vesicle-fusing ATPase	0.0232	0.2244	0.8
Mycobacterium tuberculosis	Inositol-1-monophosphatase SuhB	0.004	0.0251	0.0325
Toxoplasma gondii	cell division protein CDC48AP	0.0237	0.2293	0.5767
Trichomonas vaginalis	myo inositol monophosphatase, putative	0.0045	0.03	0.0646
Leishmania major	4-coumarate:coa ligase-like protein	0.0047	0.0327	0.0756
Trypanosoma cruzi	katanin, putative	0.002	0.0048	0.0000053311
Echinococcus multilocularis	katanin p60 ATPase containing subunit A1	0.002	0.0048	0.0048
Echinococcus multilocularis	transitional endoplasmic reticulum atpase	0.0164	0.1534	0.1534
Entamoeba histolytica	transitional endoplasmic reticulum ATPase, putative	0.0375	0.373	1
Echinococcus multilocularis	survival motor neuron protein 1	0.0286	0.2801	0.2801
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0327	0.1166
Loa Loa (eye worm)	hypothetical protein	0.0232	0.2244	0.8012
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0203	0.0724
Loa Loa (eye worm)	ATPase	0.002	0.0048	0.0172
Brugia malayi	fidgetin protein	0.002	0.0048	0.0109
Schistosoma mansoni	cell division control protein 48 aaa family protein	0.0375	0.373	0.9457
Echinococcus granulosus	transitional endoplasmic reticulum atpase	0.0395	0.3941	1
Mycobacterium ulcerans	long-chain-fatty-acid-CoA ligase	0.0047	0.0327	0.0592
Schistosoma mansoni	cell division control protein 48 aaa family protein	0.0395	0.3941	1
Echinococcus multilocularis	vacuolar protein sorting associated protein 4A	0.002	0.0048	0.0048
Loa Loa (eye worm)	fidgetin protein	0.002	0.0048	0.0172
Brugia malayi	SAP1 protein	0.002	0.0048	0.0109
Schistosoma mansoni	lamin	0.0033	0.0175	0.0325
Plasmodium vivax	cell division cycle protein 48 homologue, putative	0.0375	0.373	1
Echinococcus granulosus	survival motor neuron protein 1	0.0286	0.2801	0.7106
Echinococcus multilocularis	transitional endoplasmic reticulum atpase	0.0395	0.3941	0.3941
Schistosoma mansoni	survival motor neuron protein	0.0058	0.0441	0.101
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0055	0.041	0.041
Wolbachia endosymbiont of Brugia malayi	fructose-1,6-bisphosphatase	0.0045	0.03	0.5
Schistosoma mansoni	lamin	0.0033	0.0175	0.0325
Brugia malayi	AMP-binding enzyme family protein	0.0047	0.0327	0.1109
Leishmania major	4-coumarate:coa ligase-like protein	0.0047	0.0327	0.0756
Brugia malayi	transitional endoplasmic reticulum ATPase TER94, putative	0.0164	0.1534	0.5449
Toxoplasma gondii	inositol(myo)-1(or 4)-monophosphatase 2, putative	0.0045	0.03	0.0646
Onchocerca volvulus	Transitional endoplasmic reticulum ATPase homolog	0.0395	0.3941	1
Loa Loa (eye worm)	inositol-1	0.0045	0.03	0.107
Schistosoma mansoni	hypothetical protein	0.0058	0.0441	0.101
Loa Loa (eye worm)	vesicle-fusing ATPase	0.0232	0.2244	0.8012
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0055	0.041	0.041
Trypanosoma cruzi	metalloprotease, putative	0.002	0.0048	0.0000053311
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0169	0.0602
Loa Loa (eye worm)	VCP protein	0.0164	0.1534	0.5478
Schistosoma mansoni	inositol monophosphatase	0.0045	0.03	0.0646
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.041	0.093
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0203	0.0724
Trichomonas vaginalis	myo inositol monophosphatase, putative	0.0045	0.03	0.0646
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0047	0.0327	1
Leishmania major	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0045	0.03	0.0683
Brugia malayi	ATPase, AAA family protein	0.002	0.0048	0.0109
Echinococcus granulosus	katanin p60 ATPase containing subunit A1	0.002	0.0048	0.0122
Echinococcus multilocularis	lamin dm0	0.0033	0.0175	0.0175
Trypanosoma cruzi	katanin, putative	0.002	0.0048	0.0000053311
Trichomonas vaginalis	proteasome-activating nucleotidase, putative	0.0093	0.0807	0.195
Trypanosoma cruzi	vacuolar protein sorting-associated protein 4, putative	0.002	0.0048	0.0000053311
Trypanosoma cruzi	katanin, putative	0.002	0.0048	0.0000053311
Toxoplasma gondii	cell division protein CDC48CY	0.0395	0.3941	1
Loa Loa (eye worm)	cytoplasmic intermediate filament protein	0.0017	0.0018	0.0064
Loa Loa (eye worm)	vps4b-prov protein	0.002	0.0048	0.0172
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0047	0.0327	0.0681
Brugia malayi	AMP-binding enzyme family protein	0.0047	0.0327	0.1109
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0327	0.1166
Mycobacterium ulcerans	long-chain-fatty-acid--CoA ligase	0.0047	0.0327	0.0592
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0047	0.0327	1
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0055	0.041	0.1465
Toxoplasma gondii	transitional endoplasmic reticulum ATPase, putative	0.0237	0.2293	0.5767
Onchocerca volvulus		0.0047	0.0327	0.076
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0055	0.041	0.141
Giardia lamblia	AAA family ATPase	0.0237	0.2293	1
Mycobacterium ulcerans	long-chain fatty-acid CoA ligase	0.0047	0.0327	0.0592
Trichomonas vaginalis	spermatogenesis associated factor, putative	0.0395	0.3941	1
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.041	0.093
Mycobacterium tuberculosis	Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase)	0.0047	0.0327	0.0681
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.041	0.093
Mycobacterium ulcerans	ATPase	0.0237	0.2293	1
Mycobacterium tuberculosis	Putative conserved ATPase	0.0237	0.2293	1

Activities

Activity type	Activity value	Assay description	Source	Reference
EC50 (functional)	> 79.37 um	PUBCHEM_BIOASSAY: TR-FRET dose response biochemical High Throughput Screening assay for agonists of the steroid receptor coactivator 2 (SRC-2) recruitment by the peroxisome proliferator-activated receptor gamma (PPAR gamma): non-selective agonists. (Class of assay: confirmatory) [Related pubchem assays: 1297, 1032 ]	ChEMBL.	No reference
EC50 (functional)	> 79.37 um	PUBCHEM_BIOASSAY: TR-FRET dose response biochemical High Throughput Screening assay for agonists of the steroid receptor coactivator 3 (SRC-3) recruitment by the peroxisome proliferator-activated receptor gamma (PPAR gamma): non-selective agonists. (Class of assay: confirmatory) [Related pubchem assays: 1301 (Confirmation screen.), 1048 (Primary screen.)]	ChEMBL.	No reference
EC50 (binding)	> 79.37 uM	PUBCHEM_BIOASSAY: TR-FRET dose response biochemical High Throughput Screening assay for agonists of the steroid receptor coactivator 1 (SRC-1) recruitment by the peroxisome proliferator-activated receptor gamma (PPAR gamma): non-selective agonists. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID1300, AID1808, AID504735, AID631]	ChEMBL.	No reference
IC50 (functional)	> 20 uM	PUBCHEM_BIOASSAY: Dose Response confirmation of uHTS for the identification of UBC13 Polyubiquitin Inhibitors via a TR-FRET Assay. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID485273, AID485343, AID493182]	ChEMBL.	No reference
Potency (functional)	11.6891 uM	PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850]	ChEMBL.	No reference
Potency (functional)	= 12.5893 um	PUBCHEM_BIOASSAY: qHTS Assay for Modulators of Lamin A Splicing. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	= 12.5893 um	PUBCHEM_BIOASSAY: qHTS Assay for Identifying the Cell-Membrane Permeable IMPase Inhibitors: Potentiation with Lithium. (Class of assay: confirmatory) [Related pubchem assays: 901 ]	ChEMBL.	No reference
Potency (functional)	18.3564 uM	PUBCHEM_BIOASSAY: qHTS screen for small molecules that inhibit ELG1-dependent DNA repair in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493107, AID493125]	ChEMBL.	No reference
Potency (functional)	= 19.9526 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase). (Class of assay: confirmatory) [Related pubchem assays: 2429 (Confirmation qHTS Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase)), 2407 (Probe Development Summary for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase)), 2427 (Thermal Shift Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase))]	ChEMBL.	No reference
Potency (functional)	20.5962 uM	PUBCHEM_BIOASSAY: qHTS screen for small molecules that induce genotoxicity in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493106, AID493143]	ChEMBL.	No reference
Potency (functional)	= 25.1189 um	PUBCHEM_BIOASSAY: qHTS Multiplex Assay to Identify Dual Action Probes in a Cell Model of Huntington: Aggregate Formation (GFP). (Class of assay: confirmatory) [Related pubchem assays: 1482, 1471 ]	ChEMBL.	No reference
Potency (functional)	28.1838 uM	PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	31.6228 uM	PubChem BioAssay. qHTS Assay for Activators of ClpP. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	89.1251 uM	PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962]	ChEMBL.	No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Plasmodium falciparum	ChEMBL23

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: CHEMBL1348824
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Bibliographic References

No literature references available for this target.

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Detailed information for compound 831758