TDR Targets

Basic information

Technical information

TDR Targets ID: 332337
Name: 2-(4-chlorophenyl)-3-cyclohexyl-1-[2-(4-methy lsulfonylpiperazin-1-yl)-2-oxoethyl]indole-6- carboxylic acid
MW: 558.089 | Formula: C28H32ClN3O5S
H donors: 1 H acceptors: 5 LogP: 5.04 Rotable bonds: 7
Rule of 5 violations (Lipinski): 2
SMILES: Clc1ccc(cc1)c1c(C2CCCCC2)c2c(n1CC(=O)N1CCN(CC1)S(=O)(=O)C)cc(cc2)C(=O)O
InChi: 1S/C28H32ClN3O5S/c1-38(36,37)31-15-13-30(14-16-31)25(33)18-32-24-17-21(28(34)35)9-12-23(24)26(19-5-3-2-4-6-19)27(32)20-7-10-22(29)11-8-20/h7-12,17,19H,2-6,13-16,18H2,1H3,(H,34,35)
InChiKey: SHWLQEMPBGEKRV-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

2-(4-chlorophenyl)-3-cyclohexyl-1-[2-(4-methylsulfonylpiperazin-1-yl)-2-oxo-ethyl]indole-6-carboxylic acid
2-(4-chlorophenyl)-3-cyclohexyl-1-[2-(4-methylsulfonyl-1-piperazinyl)-2-oxoethyl]-6-indolecarboxylic acid
2-(4-chlorophenyl)-3-cyclohexyl-1-[2-keto-2-(4-mesylpiperazino)ethyl]indole-6-carboxylic acid
1H-Indole-6-carboxylic acid, 2-(4-chlorophenyl)-3-cyclohexyl-1-[2-[4-(methylsulfonyl)-1-piperazinyl]-2-oxoethyl]-
AIDS-335187
AIDS335187

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Hepatitis C virus	Hepatitis C virus NS5B RNA-dependent RNA polymerase	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Leishmania infantum	PIF1 helicase-like protein, putative,DNA repair and recombination protein, mitochondrial precursor, putative	Get druggable targets OG5_128192	All targets in OG5_128192
Trypanosoma cruzi	DNA repair and recombination helicase protein PIF7, putative	Get druggable targets OG5_128192	All targets in OG5_128192
Leishmania braziliensis	PIF1 helicase-like protein, putative,DNA repair and recombination protein, mitochondrial precursor, putative	Get druggable targets OG5_128192	All targets in OG5_128192
Leishmania major	PIF1 helicase-like protein, putative,DNA repair and recombination protein, mitochondrial precursor, putative	Get druggable targets OG5_128192	All targets in OG5_128192
Leishmania braziliensis	PIF1 helicase-like protein, putative,DNA repair and recombination protein, mitochondrial precursor, putative	Get druggable targets OG5_128192	All targets in OG5_128192
Leishmania major	PIF1 helicase-like protein, putative,DNA repair and recombination protein, mitochondrial precursor, putative	Get druggable targets OG5_128192	All targets in OG5_128192
Leishmania mexicana	PIF1 helicase-like protein, putative,DNA repair and recombination protein, mitochondrial precursor, putative	Get druggable targets OG5_128192	All targets in OG5_128192
Trypanosoma cruzi	DNA repair and recombination helicase protein PIF6, putative	Get druggable targets OG5_128192	All targets in OG5_128192
Giardia lamblia	Rrm3p helicase	Get druggable targets OG5_128192	All targets in OG5_128192
Schistosoma mansoni	hypothetical protein	Get druggable targets OG5_128192	All targets in OG5_128192
Candida albicans	similar to putative DNA helicase involved in repair and recombination of mitochondrial DNA that also plays a role in (nuclear) c	Get druggable targets OG5_128192	All targets in OG5_128192
Entamoeba histolytica	hypothetical protein, conserved	Get druggable targets OG5_128192	All targets in OG5_128192
Echinococcus granulosus	ATP dependent DNA helicase PIF1	Get druggable targets OG5_128192	All targets in OG5_128192
Trypanosoma cruzi	DNA repair and recombination helicase protein PIF7, putative	Get druggable targets OG5_128192	All targets in OG5_128192
Leishmania donovani	PIF1 helicase-like protein, putative	Get druggable targets OG5_128192	All targets in OG5_128192
Candida albicans	DNA helicase	Get druggable targets OG5_128192	All targets in OG5_128192
Candida albicans	similar to PIF1 DNA helicase	Get druggable targets OG5_128192	All targets in OG5_128192
Trypanosoma brucei gambiense	DNA repair and recombination helicase protein PIF1, putative,DNA repair and recombination protein, mitochondrial precursor, puta	Get druggable targets OG5_128192	All targets in OG5_128192
Trypanosoma brucei	DNA repair and recombination helicase protein PIF7	Get druggable targets OG5_128192	All targets in OG5_128192
Trichomonas vaginalis	conserved hypothetical protein	Get druggable targets OG5_128192	All targets in OG5_128192
Trypanosoma congolense	DNA repair and recombination helicase protein PIF6	Get druggable targets OG5_128192	All targets in OG5_128192
Leishmania mexicana	PIF1 helicase-like protein, putative,DNA repair and recombination protein, mitochondrial precursor, putative	Get druggable targets OG5_128192	All targets in OG5_128192
Echinococcus multilocularis	ATP dependent DNA helicase PIF1	Get druggable targets OG5_128192	All targets in OG5_128192
Trypanosoma brucei gambiense	DNA repair and recombination helicase protein PIF1, putative,DNA repair and recombination protein, mitochondrial precursor, puta	Get druggable targets OG5_128192	All targets in OG5_128192
Entamoeba histolytica	DNA repair and recombination protein, putative	Get druggable targets OG5_128192	All targets in OG5_128192
Trypanosoma brucei	DNA repair and recombination helicase protein PIF6	Get druggable targets OG5_128192	All targets in OG5_128192
Leishmania donovani	PIF1 helicase-like protein, putative	Get druggable targets OG5_128192	All targets in OG5_128192
Leishmania infantum	PIF1 helicase-like protein, putative,DNA repair and recombination protein, mitochondrial precursor, putative	Get druggable targets OG5_128192	All targets in OG5_128192
Trypanosoma congolense	DNA repair and recombination protein, mitochondrial precursor, putative	Get druggable targets OG5_128192	All targets in OG5_128192
Schistosoma japonicum	ko:K01529 PIF1 5'-to-3' DNA helicase [EC:3.6.1.-], putative	Get druggable targets OG5_128192	All targets in OG5_128192

By sequence similarity to non orthologous known druggable targets

No druggable targets predicted by sequence similarity

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0045	0.0465	0.0404
Echinococcus multilocularis	musashi	0.0026	0.0185	0.0123
Echinococcus granulosus	Glycosyl transferase family 35	0.0105	0.1375	0.132
Trichomonas vaginalis	Importin beta-1 subunit, putative	0.0023	0.0132	0.0194
Brugia malayi	hypothetical protein	0.0099	0.1285	0.3561
Brugia malayi	M-phase phosphoprotein, mpp8	0.0099	0.1285	0.3561
Entamoeba histolytica	Ran family GTPase	0.0021	0.01	0.0276
Trypanosoma cruzi	PAB1-binding protein , putative	0.0024	0.0158	0.0709
Giardia lamblia	Pyrophosphate-fructose 6-phosphate 1-phosphotransferase alpha subunit	0.0029	0.0221	0.1199
Trypanosoma brucei	inositol-1(or 4)-monophosphatase 1, putative	0.0036	0.0333	0.2023
Echinococcus multilocularis	importin subunit beta 1	0.0028	0.0213	0.015
Mycobacterium ulcerans	extragenic suppressor protein SuhB	0.0036	0.0333	0.2023
Schistosoma mansoni	glycogen phosphorylase	0.0105	0.1375	0.132
Trypanosoma brucei	cytidine deaminase	0.0055	0.0623	0.4205
Entamoeba histolytica	glycogen phosphorylase, putative	0.0045	0.0473	0.3077
Plasmodium falciparum	importin beta, putative	0.0028	0.0213	0.95
Trichomonas vaginalis	phosphofructokinase, putative	0.0106	0.1395	0.3756
Echinococcus multilocularis	lamin dm0	0.0026	0.0185	0.0123
Entamoeba histolytica	glycogen phosphorylase, putative	0.0105	0.1375	0.9851
Echinococcus multilocularis	survival motor neuron protein 1	0.0231	0.3286	0.3243
Echinococcus multilocularis	Glycosyl transferase, family 35	0.0105	0.1375	0.132
Trypanosoma cruzi	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0036	0.0333	0.2023
Entamoeba histolytica	myo-inositol monophosphatase, putative	0.0036	0.0333	0.2023
Loa Loa (eye worm)	glycogen phosphorylase	0.0105	0.1375	0.3068
Schistosoma mansoni	multiple ankyrin repeats single kh domain protein	0.0088	0.1116	0.106
Echinococcus granulosus	flap endonuclease 1	0.0025	0.0172	0.0109
Trypanosoma cruzi	flap endonuclease-1 (FEN-1), putative	0.0025	0.0172	0.0812
Mycobacterium leprae	PROBABLE 6-PHOSPHOFRUCTOKINASE PFKA (PHOSPHOHEXOKINASE) (PHOSPHOFRUCTOKINASE)	0.0106	0.1395	1
Echinococcus granulosus	histone lysine methyltransferase setb	0.0029	0.0228	0.0166
Brugia malayi	Flap endonuclease-1	0.0025	0.0172	0.0476
Trichomonas vaginalis	glucosylceramidase, putative	0.0252	0.3609	1
Toxoplasma gondii	HEAT repeat-containing protein	0.0028	0.0213	0.267
Brugia malayi	intermediate filament protein	0.0026	0.0185	0.0514
Echinococcus granulosus	solute carrier family 28	0.0353	0.5147	0.5116
Onchocerca volvulus	Glycogen phosphorylase homolog	0.0105	0.1375	0.383
Mycobacterium ulcerans	6-phosphofructokinase	0.0106	0.1395	1
Brugia malayi	hypothetical protein	0.0024	0.0158	0.0437
Plasmodium falciparum	ataxin-2 like protein, putative	0.0024	0.0158	0.5998
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0228	0.3249	0.725
Wolbachia endosymbiont of Brugia malayi	fructose-1,6-bisphosphatase	0.0036	0.0333	1
Echinococcus granulosus	GTP binding nuclear protein Ran	0.0021	0.01	0.0037
Trypanosoma cruzi	cytidine deaminase-like protein	0.0055	0.0623	0.4205
Trypanosoma brucei	GTP-binding nuclear protein rtb2, putative	0.0021	0.01	0.0276
Trichomonas vaginalis	glucosylceramidase, putative	0.0165	0.2294	0.6292
Toxoplasma gondii	cytidine and deoxycytidylate deaminase zinc-binding region domain-containing protein	0.0055	0.0623	1
Echinococcus granulosus	glycogen phosphorylase	0.0105	0.1375	0.132
Loa Loa (eye worm)	hypothetical protein	0.0099	0.1285	0.2868
Leishmania major	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0036	0.0333	0.2023
Trichomonas vaginalis	glucosylceramidase, putative	0.0174	0.2429	0.6673
Onchocerca volvulus		0.0099	0.1285	0.354
Plasmodium vivax	GTP-binding nuclear protein RAN/TC4, putative	0.0021	0.01	0.2236
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.0029	0.0228	0.2938
Trichomonas vaginalis	myo inositol monophosphatase, putative	0.0036	0.0333	0.076
Trypanosoma cruzi	ATP-dependent 6-phosphofructokinase, glycosomal	0.0106	0.1395	1
Mycobacterium tuberculosis	Probable glycogen phosphorylase GlgP	0.0045	0.0473	0.3077
Echinococcus multilocularis	inositol monophosphatase 1	0.0036	0.0333	0.0271
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0029	0.0228	0.0166
Onchocerca volvulus		0.004	0.0397	0.0681
Echinococcus granulosus	snurportin 1	0.03	0.4342	0.4306
Leishmania major	importin beta-1 subunit, putative	0.0023	0.0132	0.0516
Trichomonas vaginalis	flap endonuclease-1, putative	0.0025	0.0172	0.0305
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0203	0.2867	0.6396
Leishmania major	GTP-binding protein, putative	0.0021	0.01	0.0276
Echinococcus granulosus	cytidine deaminase	0.0055	0.0623	0.0563
Loa Loa (eye worm)	hypothetical protein	0.0231	0.3286	0.7332
Trichomonas vaginalis	phosphofructokinase, putative	0.0029	0.0221	0.0444
Trypanosoma brucei	flap endonuclease-1 (FEN-1), putative	0.0025	0.0172	0.0812
Schistosoma mansoni	multiple ankyrin repeats single kh domain protein	0.0088	0.1116	0.106
Toxoplasma gondii	phosphofructokinase PFKII	0.0029	0.0221	0.281
Brugia malayi	hypothetical protein	0.0119	0.1588	0.44
Trichomonas vaginalis	phosphofructokinase, putative	0.0029	0.0221	0.0444
Brugia malayi	hypothetical protein	0.0016	0.0026	0.0072
Schistosoma mansoni	inositol monophosphatase	0.0036	0.0333	0.0271
Echinococcus granulosus	intermediate filament protein	0.0026	0.0185	0.0123
Trichomonas vaginalis	glucosylceramidase, putative	0.0252	0.3609	1
Brugia malayi	phosphofructokinase	0.0106	0.1395	0.3866
Trichomonas vaginalis	glucosylceramidase, putative	0.0165	0.2294	0.6292
Loa Loa (eye worm)	phosphofructokinase	0.0106	0.1395	0.3113
Trichomonas vaginalis	glucosylceramidase, putative	0.0165	0.2294	0.6292
Echinococcus granulosus	lamin	0.0026	0.0185	0.0123
Loa Loa (eye worm)	O-glycosyl hydrolase family 30 protein	0.0252	0.3609	0.8052
Trypanosoma cruzi	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0036	0.0333	0.2023
Echinococcus multilocularis	6 phosphofructokinase	0.0106	0.1395	0.134
Toxoplasma gondii	LsmAD domain-containing protein	0.0024	0.0158	0.1686
Trichomonas vaginalis	inositol monophosphatase, putative	0.0036	0.0333	0.076
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0158	0.0352
Echinococcus multilocularis	concentrative Na+ nucleoside cotransporter	0.0353	0.5147	0.5116
Loa Loa (eye worm)	6-phosphofructokinase	0.0106	0.1395	0.3113
Leishmania major	ATP-dependent phosphofructokinase	0.0106	0.1395	1
Echinococcus granulosus	6 phosphofructokinase	0.0106	0.1395	0.134
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0045	0.0465	0.1038
Trichomonas vaginalis	importin beta-1, putative	0.0023	0.0132	0.0194
Plasmodium falciparum	GTP-binding nuclear protein RAN/TC4	0.0021	0.01	0.2338
Brugia malayi	Importin beta-1 subunit	0.0028	0.0213	0.059
Plasmodium vivax	SET domain protein, putative	0.0029	0.0228	1
Plasmodium falciparum	flap endonuclease 1	0.0025	0.0172	0.6872
Schistosoma mansoni	hypothetical protein	0.0047	0.05	0.0439
Plasmodium falciparum	ATP-dependent 6-phosphofructokinase	0.0029	0.0221	1
Entamoeba histolytica	glycogenphosphorylase, putative	0.0045	0.0473	0.3077
Echinococcus multilocularis	lamin	0.0026	0.0185	0.0123
Schistosoma mansoni	ran	0.0021	0.01	0.0037
Giardia lamblia	GTP-binding nuclear protein RAN/TC4	0.0021	0.01	0.028
Chlamydia trachomatis	glycogen phosphorylase	0.0105	0.1375	1
Trypanosoma cruzi	DNA repair and recombination helicase protein PIF7, putative	0.0034	0.0296	0.1745
Loa Loa (eye worm)	hypothetical protein	0.0099	0.1285	0.2868
Trypanosoma brucei	DNA repair and recombination helicase protein PIF6	0.0034	0.0296	0.1745
Trypanosoma cruzi	PAB1-binding protein , putative	0.0024	0.0158	0.0709
Trypanosoma cruzi	GTP-binding nuclear protein rtb2, putative	0.0021	0.01	0.0276
Trichomonas vaginalis	set domain proteins, putative	0.0231	0.3292	0.9107
Echinococcus multilocularis	flap endonuclease 1	0.0025	0.0172	0.0109
Trichomonas vaginalis	glucosylceramidase, putative	0.0174	0.2429	0.6673
Echinococcus multilocularis	solute carrier family 28	0.0353	0.5147	0.5116
Trichomonas vaginalis	glucosylceramidase, putative	0.0165	0.2294	0.6292
Echinococcus multilocularis	glycogen phosphorylase	0.0105	0.1375	0.132
Echinococcus granulosus	concentrative Na nucleoside cotransporter	0.0353	0.5147	0.5116
Brugia malayi	Pre-SET motif family protein	0.0203	0.2867	0.7944
Trichomonas vaginalis	glucosylceramidase, putative	0.0252	0.3609	1
Trichomonas vaginalis	glucosylceramidase, putative	0.0165	0.2294	0.6292
Schistosoma mansoni	hypothetical protein	0.0034	0.0296	0.0234
Echinococcus multilocularis	sodium:nucleoside cotransporter 2	0.023	0.3282	0.3239
Loa Loa (eye worm)	intermediate filament protein	0.0026	0.0185	0.0414
Echinococcus granulosus	geminin	0.0339	0.4937	0.4905
Brugia malayi	GTP-binding nuclear protein RAN/TC4	0.0021	0.01	0.0278
Echinococcus multilocularis	microtubule associated protein 2	0.0673	1	1
Loa Loa (eye worm)	GTP-binding nuclear protein RAN/TC4	0.0021	0.01	0.0224
Trichomonas vaginalis	phosphofructokinase, putative	0.0106	0.1395	0.3756
Echinococcus granulosus	Na+ dependent nucleoside transporter	0.0353	0.5147	0.5116
Schistosoma mansoni	hypothetical protein	0.03	0.4342	0.4306
Echinococcus granulosus	ATP dependent DNA helicase PIF1	0.0034	0.0296	0.0234
Schistosoma mansoni	glycogen phosphorylase	0.0045	0.0473	0.0412
Trypanosoma brucei	PAB1-binding protein , putative	0.0024	0.0158	0.0709
Trypanosoma cruzi	importin beta-1 subunit, putative	0.0023	0.0132	0.0516
Trichomonas vaginalis	cytidine deaminase, putative	0.0055	0.0623	0.1579
Schistosoma mansoni	hypothetical protein	0.0339	0.4937	0.4905
Loa Loa (eye worm)	nucleolar RNA-associated protein alpha	0.03	0.4342	0.9689
Echinococcus multilocularis	Ankyrin repeat domain containing protein	0.0088	0.1116	0.106
Onchocerca volvulus		0.0231	0.3292	1
Brugia malayi	RNA, U transporter 1	0.008	0.1	0.2771
Mycobacterium leprae	PROBABLE CYTIDINE DEAMINASE CDD (CYTIDINE AMINOHYDROLASE) (CYTIDINE NUCLEOSIDE DEAMINASE)	0.0055	0.0623	0.3107
Brugia malayi	follicle stimulating hormone receptor	0.0228	0.3249	0.9005
Brugia malayi	6-phosphofructokinase	0.0106	0.1395	0.3866
Toxoplasma gondii	GTP-binding nuclear protein ran/tc4	0.0021	0.01	0.0657
Trichomonas vaginalis	phosphofructokinase, putative	0.0029	0.0221	0.0444
Brugia malayi	Pre-SET motif family protein	0.0029	0.0228	0.0632
Loa Loa (eye worm)	hypothetical protein	0.0309	0.4482	1
Entamoeba histolytica	cytidine deaminase, putative	0.0055	0.0623	0.4205
Trichomonas vaginalis	phosphofructokinase, putative	0.0029	0.0221	0.0444
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0228	0.0509
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0029	0.0228	0.0166
Schistosoma mansoni	importin beta-1	0.0028	0.0213	0.015
Schistosoma mansoni	6-phosphofructokinase	0.0106	0.1395	0.134
Schistosoma mansoni	flap endonuclease-1	0.0023	0.0135	0.0072
Schistosoma mansoni	hypothetical protein	0.0339	0.4937	0.4905
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0045	0.0465	0.0404
Trypanosoma cruzi	GTP-binding nuclear protein rtb2, putative	0.0021	0.01	0.0276
Leishmania major	hypothetical protein, conserved	0.0024	0.0158	0.0709
Giardia lamblia	Rrm3p helicase	0.0034	0.0296	0.1771
Onchocerca volvulus		0.0055	0.0623	0.141
Entamoeba histolytica	pyrophosphate-dependent phosphofructokinase	0.0029	0.0221	0.1182
Toxoplasma gondii	inositol(myo)-1(or 4)-monophosphatase 2, putative	0.0036	0.0333	0.4811
Leishmania major	PIF1 helicase-like protein, putative,DNA repair and recombination protein, mitochondrial precursor, putative	0.0034	0.0296	0.1745
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0045	0.0465	0.1289
Onchocerca volvulus	Glucosylceramidase homolog	0.0165	0.2294	0.6788
Giardia lamblia	Cytidine deaminase	0.0055	0.0623	0.4268
Brugia malayi	cytidine deaminase, identical	0.0055	0.0623	0.1727
Mycobacterium tuberculosis	Inositol-1-monophosphatase SuhB	0.0032	0.0276	0.1593
Trichomonas vaginalis	glucosylceramidase, putative	0.0165	0.2294	0.6292
Plasmodium vivax	6-phosphofructokinase, putative	0.0029	0.0221	0.9563
Echinococcus multilocularis	snurportin 1	0.03	0.4342	0.4306
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.0465	0.0404
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0029	0.0228	0.0166
Schistosoma mansoni	inositol monophosphatase	0.0036	0.0333	0.0271
Giardia lamblia	Flap structure-specific endonuclease	0.0025	0.0172	0.0824
Mycobacterium tuberculosis	Probable cytidine deaminase Cdd (cytidine aminohydrolase) (cytidine nucleoside deaminase)	0.0055	0.0623	0.4205
Mycobacterium ulcerans	cytidine deaminase	0.0055	0.0623	0.4205
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	0.0018	0.0064	0.0142
Entamoeba histolytica	phosphofructokinase, putative	0.0106	0.1395	1
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0213	0.0475
Trypanosoma brucei	importin beta-1 subunit, putative	0.0028	0.0213	0.1122
Loa Loa (eye worm)	inositol-1	0.0036	0.0333	0.0743
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0026	0.0185	0.0414
Schistosoma mansoni	intermediate filament proteins	0.0026	0.0185	0.0123
Giardia lamblia	Glycogen phosphorylase	0.0105	0.1375	1
Brugia malayi	Inositol-1	0.0036	0.0333	0.0922
Schistosoma mansoni	glycogen phosphorylase	0.0105	0.1375	0.132
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0029	0.0228	0.0166
Entamoeba histolytica	DNA repair and recombination protein, putative	0.0034	0.0296	0.1745
Trichomonas vaginalis	conserved hypothetical protein	0.0034	0.0296	0.0655
Echinococcus multilocularis	GTP binding nuclear protein Ran	0.0021	0.01	0.0037
Trichomonas vaginalis	phosphofructokinase, putative	0.0029	0.0221	0.0444
Brugia malayi	Intermediate filament tail domain containing protein	0.0026	0.0185	0.0514
Entamoeba histolytica	hypothetical protein	0.0023	0.0132	0.0516
Entamoeba histolytica	glycogen phosphorylase, putative	0.0105	0.1375	0.9851
Trichomonas vaginalis	cytidine deaminase, putative	0.0055	0.0623	0.1579
Trichomonas vaginalis	myo inositol monophosphatase, putative	0.0036	0.0333	0.076
Trichomonas vaginalis	phosphofructokinase, putative	0.0029	0.0221	0.0444
Trichomonas vaginalis	Importin beta-1 subunit, putative	0.0023	0.0132	0.0194
Echinococcus granulosus	glycogen phosphorylase	0.0105	0.1375	0.132
Trypanosoma brucei	ATP-dependent 6-phosphofructokinase, glycosomal	0.0106	0.1395	1
Trypanosoma cruzi	cytidine deaminase-like protein, putative	0.0055	0.0623	0.4205
Plasmodium vivax	importin-beta 2, putative	0.0028	0.0213	0.9085
Plasmodium falciparum	ATP-dependent 6-phosphofructokinase	0.0029	0.0221	1
Brugia malayi	hypothetical protein	0.0231	0.3286	0.9106
Entamoeba histolytica	phosphofructokinase, putative	0.0106	0.1395	1
Onchocerca volvulus		0.0055	0.0623	0.141
Toxoplasma gondii	flap structure-specific endonuclease 1, putative	0.0025	0.0172	0.1931
Trypanosoma brucei	importin beta-1 subunit, putative	0.0028	0.0213	0.1122
Entamoeba histolytica	glycogen phosphorylase, putative	0.0045	0.0473	0.3077
Echinococcus multilocularis	glycogen phosphorylase	0.0105	0.1375	0.132
Loa Loa (eye worm)	flap endonuclease-1	0.0025	0.0172	0.0383
Loa Loa (eye worm)	6-phosphofructokinase	0.0106	0.1395	0.3113
Plasmodium vivax	ataxin-2 like protein, putative	0.0024	0.0158	0.5736
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0045	0.0465	0.0404
Trypanosoma cruzi	DNA repair and recombination helicase protein PIF6, putative	0.0034	0.0296	0.1745
Mycobacterium ulcerans	glycogen phosphorylase GlgP	0.0045	0.0473	0.3077
Leishmania major	cytidine deaminase-like protein	0.0055	0.0623	0.4205
Trichomonas vaginalis	glycogen phosphorylase, putative	0.0105	0.1375	0.37
Onchocerca volvulus		0.0047	0.05	0.1013
Entamoeba histolytica	Flap nuclease, putative	0.0025	0.0172	0.0812
Trichomonas vaginalis	glycogen phosphorylase, putative	0.0105	0.1375	0.37
Trichomonas vaginalis	6-phosphofructokinase, putative	0.0029	0.0221	0.0444
Trichomonas vaginalis	glucosylceramidase, putative	0.0165	0.2294	0.6292
Treponema pallidum	diphosphate--fructose-6-phosphate 1-phosphotransferase	0.0106	0.1395	1
Brugia malayi	O-Glycosyl hydrolase family 30 protein	0.0252	0.3609	1
Trichomonas vaginalis	phosphofructokinase, putative	0.0106	0.1395	0.3756
Plasmodium vivax	flap endonuclease 1, putative	0.0025	0.0172	0.6572
Leishmania major	flap endonuclease-1 (FEN-1), putative	0.0025	0.0172	0.0812
Brugia malayi	exodeoxyribonuclease III family protein	0.0018	0.0064	0.0176
Trichomonas vaginalis	glucosylceramidase, putative	0.0252	0.3609	1
Trichomonas vaginalis	ran, putative	0.0021	0.01	0.0104
Trypanosoma brucei	DNA repair and recombination helicase protein PIF7	0.0034	0.0296	0.1745
Schistosoma mansoni	microtubule-associated protein tau	0.0673	1	1
Echinococcus multilocularis	ATP dependent DNA helicase PIF1	0.0034	0.0296	0.0234
Toxoplasma gondii	phosphofructokinase domain-containing protein	0.0029	0.0221	0.281
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0045	0.0465	0.0404
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.0465	0.0404
Echinococcus granulosus	lamin dm0	0.0026	0.0185	0.0123
Brugia malayi	6-phosphofructokinase	0.0106	0.1395	0.3866
Echinococcus granulosus	Ankyrin repeat domain containing protein	0.0088	0.1116	0.106
Schistosoma mansoni	6-phosphofructokinase	0.0106	0.1395	0.134
Schistosoma mansoni	lamin	0.0026	0.0185	0.0123
Entamoeba histolytica	hypothetical protein, conserved	0.0034	0.0296	0.1745
Leishmania major	PIF1 helicase-like protein, putative,DNA repair and recombination protein, mitochondrial precursor, putative	0.0034	0.0296	0.1745
Echinococcus granulosus	survival motor neuron protein 1	0.0231	0.3286	0.3243
Plasmodium vivax	6-phosphofructokinase, putative	0.0029	0.0221	0.9563
Toxoplasma gondii	6-phosphofructokinase	0.0029	0.0221	0.281
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0185	0.0414
Echinococcus granulosus	importin subunit beta 1	0.0028	0.0213	0.015
Entamoeba histolytica	phosphofructokinase, putative	0.0106	0.1395	1
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.0465	0.0404
Trichomonas vaginalis	glucosylceramidase, putative	0.0252	0.3609	1
Trichomonas vaginalis	glucosylceramidase, putative	0.0252	0.3609	1
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.004	0.0397	0.0335
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.0028	0.0212	0.0149
Plasmodium falciparum	ataxin-2 like protein, putative	0.0024	0.0158	0.5998
Echinococcus multilocularis	geminin	0.0339	0.4937	0.4905
Treponema pallidum	diphosphate--fructose-6-phosphate 1-phosphotransferase	0.0029	0.0221	0.1182
Echinococcus multilocularis	cytidine deaminase	0.0055	0.0623	0.0563
Trichomonas vaginalis	phosphofructokinase, putative	0.0106	0.1395	0.3756
Onchocerca volvulus		0.0099	0.1285	0.354
Schistosoma mansoni	ran	0.0021	0.01	0.0037
Mycobacterium tuberculosis	Probable 6-phosphofructokinase PfkA (phosphohexokinase) (phosphofructokinase)	0.0106	0.1395	1
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.0029	0.0228	0.0166
Brugia malayi	carbohydrate phosphorylase	0.0105	0.1375	0.3811
Echinococcus granulosus	inositol monophosphatase 1	0.0036	0.0333	0.0271
Brugia malayi	Iron-sulfur cluster assembly accessory protein	0.0047	0.05	0.1386
Trypanosoma cruzi	DNA repair and recombination helicase protein PIF7, putative	0.0034	0.0296	0.1745
Schistosoma mansoni	lamin	0.0026	0.0185	0.0123
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0178	0.0397
Schistosoma mansoni	survival motor neuron protein	0.0047	0.05	0.0439

Activities

Activity type	Activity value	Assay description	Source	Reference
EC50 (functional)	= 0.5 uM	Effective concentration required to inhibit replication of subgenomic HCV RNA in HUH-7 cells	ChEMBL.	15999993
EC50 (functional)	= 0.5 uM	Effective concentration required to inhibit replication of subgenomic HCV RNA in HUH-7 cells	ChEMBL.	15999993
IC50 (binding)	= 7 nM	Inhibitory activity against by hepatitis C virus NS5B polymerase	ChEMBL.	15999993
IC50 (binding)	= 7 nM	Inhibitory activity against by hepatitis C virus NS5B polymerase	ChEMBL.	15999993

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Homo sapiens	ChEMBL23	15999993

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: CHEMBL191196
PubChem: 6480897

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 332337