TDR Targets

Basic information

Technical information

TDR Targets ID: 1207174
Name: C530-1057
MW: 514.567 | Formula: C29H23FN2O4S
H donors: 0 H acceptors: 4 LogP: 4.36 Rotable bonds: 6
Rule of 5 violations (Lipinski): 2
SMILES: CN(C(=O)c1ccc2c(c1)N(Cc1ccccc1F)C(=O)c1c(S2(=O)=O)cccc1)Cc1ccccc1
InChi: 1S/C29H23FN2O4S/c1-31(18-20-9-3-2-4-10-20)28(33)21-15-16-27-25(17-21)32(19-22-11-5-7-13-24(22)30)29(34)23-12-6-8-14-26(23)37(27,35)36/h2-17H,18-19H2,1H3
InChiKey: CBKHAESPVIEXJN-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

NCGC00109570-01

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology

No druggable targets predicted by orthology data

By sequence similarity to non orthologous known druggable targets

No druggable targets predicted by sequence similarity

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Entamoeba histolytica	myo-inositol monophosphatase, putative	0.0038	0.0239	0.0499
Plasmodium vivax	ataxin-2 like protein, putative	0.0075	0.1037	0.7473
Echinococcus granulosus	histone deacetylase 1	0.0091	0.1379	0.2028
Echinococcus multilocularis	gcn5proteinral control of amino acid synthesis	0.0149	0.2636	0.3913
Trichomonas vaginalis	myo inositol monophosphatase, putative	0.0038	0.0239	0.0073
Schistosoma mansoni	hypothetical protein	0.0094	0.1439	0.2155
Loa Loa (eye worm)	hypothetical protein	0.0203	0.3793	0.3793
Entamoeba histolytica	exodeoxyribonuclease III, putative	0.0037	0.0205	0.0219
Brugia malayi	hypothetical protein	0.0075	0.1037	0.102
Trypanosoma brucei	histone deacetylase 4	0.0074	0.1015	0.7313
Leishmania major	hypothetical protein, conserved	0.0075	0.1037	0.7087
Brugia malayi	RNA recognition motif domain containing protein	0.0203	0.3792	0.378
Schistosoma mansoni	tar DNA-binding protein	0.0203	0.3792	0.5745
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0045	0.0388	0.0542
Brugia malayi	Histone deacetylase 1	0.0091	0.1379	0.1362
Toxoplasma gondii	histone deacetylase HDAC5	0.0047	0.0425	0.2946
Schistosoma mansoni	smad	0.0033	0.0131	0.016
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0094	0.1439	0.1439
Wolbachia endosymbiont of Brugia malayi	fructose-1,6-bisphosphatase	0.0038	0.0239	1
Trichomonas vaginalis	histone deacetylase, putative	0.0091	0.1379	0.2546
Mycobacterium tuberculosis	Conserved protein	0.0071	0.0935	0.0869
Loa Loa (eye worm)	hypothetical protein	0.0094	0.1439	0.1439
Trichomonas vaginalis	penicillin-binding protein, putative	0.0071	0.0935	0.1582
Echinococcus granulosus	histone deacetylase	0.0074	0.1015	0.1483
Mycobacterium tuberculosis	Probable esterase/lipase LipP	0.0071	0.0935	0.0869
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0451	0.9153	1
Brugia malayi	Smad1	0.0033	0.0131	0.0112
Loa Loa (eye worm)	hypothetical protein	0.0071	0.0935	0.0935
Trichomonas vaginalis	inositol monophosphatase, putative	0.0038	0.0239	0.0073
Mycobacterium tuberculosis	Probable hydrolase	0.0071	0.0935	0.0869
Leishmania major	hypothetical protein, conserved	0.0071	0.0935	0.6215
Mycobacterium ulcerans	fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE	0.0071	0.0935	1
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0297	0.5822	0.5814
Brugia malayi	MH2 domain containing protein	0.0033	0.0131	0.0112
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0129	0.0129
Brugia malayi	beta-lactamase family protein	0.0071	0.0935	0.0917
Loa Loa (eye worm)	hypothetical protein	0.0071	0.0935	0.0935
Trypanosoma cruzi	histone deacetylase, putative	0.0074	0.1015	0.6902
Echinococcus multilocularis	geminin	0.0332	0.658	0.9827
Schistosoma mansoni	hypothetical protein	0.0094	0.1439	0.2155
Schistosoma mansoni	histone deacetylase 1 2 3	0.0047	0.0425	0.0608
Mycobacterium tuberculosis	Conserved protein	0.0071	0.0935	0.0869
Trichomonas vaginalis	glucosylceramidase, putative	0.0164	0.2955	0.5967
Trypanosoma brucei	histone deacetylase 2	0.0047	0.0425	0.2946
Mycobacterium ulcerans	esterase/lipase LipP	0.0071	0.0935	1
Trichomonas vaginalis	glucosylceramidase, putative	0.025	0.4814	1
Echinococcus granulosus	beta LACTamase domain containing family member	0.0071	0.0935	0.1362
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0094	0.1439	0.1422
Mycobacterium tuberculosis	Probable esterase LipL	0.0071	0.0935	0.0869
Echinococcus multilocularis	snurportin 1	0.0305	0.5995	0.8949
Schistosoma mansoni	tar DNA-binding protein	0.0203	0.3792	0.5745
Trichomonas vaginalis	sucrase-isomaltase, putative	0.0039	0.0258	0.0115
Trichomonas vaginalis	D-aminoacylase, putative	0.0071	0.0935	0.1582
Loa Loa (eye worm)	histone deacetylase	0.0074	0.1015	0.1015
Trichomonas vaginalis	histone deacetylase, putative	0.0091	0.1379	0.2546
Trypanosoma brucei	histone deacetylase 1	0.0091	0.1379	1
Loa Loa (eye worm)	hypothetical protein	0.0091	0.1379	0.1379
Loa Loa (eye worm)	MH2 domain-containing protein	0.0033	0.0131	0.0131
Trypanosoma brucei	inositol-1(or 4)-monophosphatase 1, putative	0.0038	0.0239	0.1573
Schistosoma mansoni	cellular tumor antigen P53	0.0049	0.0476	0.0686
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.0388	0.0552
Leishmania major	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0038	0.0239	0.0286
Toxoplasma gondii	histone deacetylase HDAC3	0.0091	0.1379	1
Plasmodium falciparum	ataxin-2 like protein, putative	0.0075	0.1037	0.7473
Schistosoma mansoni	histone deacetylase 4 5	0.0074	0.1015	0.1509
Schistosoma mansoni	tar DNA-binding protein	0.0203	0.3792	0.5745
Plasmodium vivax	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0037	0.0205	0.1325
Trichomonas vaginalis	glucosylceramidase, putative	0.025	0.4814	1
Loa Loa (eye worm)	hypothetical protein	0.0071	0.0935	0.0935
Loa Loa (eye worm)	beta-lactamase	0.0071	0.0935	0.0935
Echinococcus granulosus	histone deacetylase 6	0.008	0.1145	0.1677
Loa Loa (eye worm)	MH2 domain-containing protein	0.049	1	1
Loa Loa (eye worm)	glycosyl hydrolase family 31 protein	0.0039	0.0258	0.0258
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0045	0.0388	0.0542
Brugia malayi	MH1 domain containing protein	0.0033	0.0131	0.0112
Loa Loa (eye worm)	O-glycosyl hydrolase family 30 protein	0.025	0.4814	0.4814
Loa Loa (eye worm)	hypothetical protein	0.0044	0.0357	0.0357
Schistosoma mansoni	TGF-beta signal transducer Smad2	0.0033	0.0131	0.016
Mycobacterium leprae	conserved hypothetical protein	0.0071	0.0935	1
Trypanosoma cruzi	histone deacetylase 1, putative	0.0091	0.1379	1
Echinococcus multilocularis	Smad4	0.0033	0.0131	0.0157
Treponema pallidum	exodeoxyribonuclease (exoA)	0.0037	0.0205	0.5
Echinococcus multilocularis	histone deacetylase	0.0074	0.1015	0.1483
Trypanosoma brucei	histone deacetylase, putative	0.0074	0.1015	0.7313
Plasmodium falciparum	histone acetyltransferase GCN5	0.004	0.0266	0.177
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	0.0037	0.0205	0.0205
Brugia malayi	RNA, U transporter 1	0.0081	0.1164	0.1147
Trypanosoma brucei	hypothetical protein, conserved	0.0071	0.0935	0.6716
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0203	0.3792	0.3792
Echinococcus granulosus	Ataxin 2 N terminaldomain containing protein	0.0034	0.0139	0.017
Echinococcus granulosus	neutral alpha glucosidase AB	0.0039	0.0258	0.0348
Schistosoma mansoni	histone deacetylase hda2	0.0047	0.0425	0.0608
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0071	0.0935	0.0935
Brugia malayi	Glycosyl hydrolases family 31 protein	0.0039	0.0258	0.024
Echinococcus granulosus	tar DNA binding protein	0.0203	0.3792	0.5646
Mycobacterium leprae	Probable lipase LipE	0.0071	0.0935	1
Trypanosoma brucei	histone deacetylase 3	0.0074	0.1015	0.7313
Onchocerca volvulus		0.0147	0.2577	0.8507
Schistosoma mansoni	ap endonuclease	0.0037	0.0205	0.0273
Schistosoma mansoni	hypothetical protein	0.0094	0.1439	0.2155
Plasmodium falciparum	histone deacetylase 1	0.0091	0.1379	1
Schistosoma mansoni	alpha glucosidase	0.0039	0.0258	0.0354
Echinococcus multilocularis	bromodomain adjacent to zinc finger domain	0.0036	0.0176	0.0225
Onchocerca volvulus		0.0071	0.0935	0.2015
Echinococcus multilocularis	histone deacetylase 8	0.0047	0.0425	0.0597
Trichomonas vaginalis	glucosylceramidase, putative	0.0164	0.2955	0.5967
Echinococcus granulosus	lysosomal alpha glucosidase	0.0177	0.3235	0.4811
Schistosoma mansoni	histone deacetylase hda2	0.008	0.1145	0.1706
Trichomonas vaginalis	alpha-glucosidase, putative	0.0039	0.0258	0.0115
Echinococcus granulosus	bromodomain adjacent to zinc finger domain	0.0063	0.0762	0.1103
Onchocerca volvulus		0.0071	0.0935	0.2015
Toxoplasma gondii	inositol(myo)-1(or 4)-monophosphatase 2, putative	0.0038	0.0239	0.1573
Schistosoma mansoni	tar DNA-binding protein	0.0203	0.3792	0.5745
Brugia malayi	acetyltransferase, GNAT family protein	0.0149	0.2636	0.2622
Loa Loa (eye worm)	hypothetical protein	0.0049	0.0476	0.0476
Mycobacterium ulcerans	hypothetical protein	0.0071	0.0935	1
Schistosoma mansoni	hypothetical protein	0.0332	0.658	1
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0094	0.1439	0.2117
Trichomonas vaginalis	histone deacetylase, putative	0.0091	0.1379	0.2546
Entamoeba histolytica	acetyltransferase, GNAT family	0.004	0.0266	0.0722
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0026	0.0026
Echinococcus multilocularis	histone deacetylase 6	0.0074	0.1015	0.1483
Schistosoma mansoni	Smad4	0.0033	0.0131	0.016
Echinococcus multilocularis	bromodomain adjacent to zinc finger domain	0.0063	0.0762	0.1103
Echinococcus multilocularis	histone deacetylase 7	0.0074	0.1015	0.1483
Trichomonas vaginalis	glucosylceramidase, putative	0.0164	0.2955	0.5967
Echinococcus granulosus	inositol monophosphatase 1	0.0038	0.0239	0.0319
Mycobacterium tuberculosis	Probable conserved lipoprotein	0.0071	0.0935	0.0869
Trichomonas vaginalis	alpha-glucosidase, putative	0.0039	0.0258	0.0115
Trichomonas vaginalis	glucosylceramidase, putative	0.0164	0.2955	0.5967
Schistosoma mansoni	hypothetical protein	0.0332	0.658	1
Trichomonas vaginalis	glucosylceramidase, putative	0.025	0.4814	1
Trichomonas vaginalis	D-aminoacylase, putative	0.0071	0.0935	0.1582
Brugia malayi	Cytochrome P450 family protein	0.0051	0.0505	0.0487
Mycobacterium ulcerans	extragenic suppressor protein SuhB	0.0038	0.0239	0.046
Trichomonas vaginalis	histone deacetylase, putative	0.0091	0.1379	0.2546
Echinococcus granulosus	histone deacetylase 6	0.0074	0.1015	0.1483
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0045	0.0388	0.0388
Loa Loa (eye worm)	histone deacetylase 3	0.0091	0.1379	0.1379
Brugia malayi	beta-lactamase	0.0071	0.0935	0.0917
Loa Loa (eye worm)	hypothetical protein	0.0297	0.5822	0.5822
Echinococcus granulosus	histone deacetylase 7	0.0074	0.1015	0.1483
Plasmodium vivax	hypothetical protein, conserved	0.0071	0.0935	0.6716
Trypanosoma cruzi	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0038	0.0239	0.0286
Leishmania major	alpha glucosidase II subunit, putative	0.0039	0.0258	0.0451
Loa Loa (eye worm)	hypothetical protein	0.0147	0.2577	0.2577
Echinococcus granulosus	Smad4	0.0033	0.0131	0.0157
Mycobacterium tuberculosis	Possible conserved lipoprotein LpqK	0.0071	0.0935	0.0869
Trichomonas vaginalis	penicillin-binding protein, putative	0.0071	0.0935	0.1582
Trypanosoma cruzi	histone deacetylase, putative	0.0074	0.1015	0.6902
Echinococcus multilocularis	GPCR, family 2	0.0094	0.1439	0.2117
Brugia malayi	Histone deacetylase family protein	0.0074	0.1015	0.0998
Trichomonas vaginalis	histone deacetylase, putative	0.0091	0.1379	0.2546
Brugia malayi	histone deacetylase 3 (HD3)	0.0091	0.1379	0.1362
Brugia malayi	MH2 domain containing protein	0.0033	0.0131	0.0112
Trypanosoma brucei	glucosidase, putative	0.0039	0.0258	0.1716
Trypanosoma cruzi	hypothetical protein, conserved	0.0071	0.0935	0.6215
Giardia lamblia	Histone acetyltransferase GCN5	0.004	0.0266	0.0514
Leishmania major	histone deacetylase, putative	0.0074	0.1015	0.6902
Schistosoma mansoni	tar DNA-binding protein	0.0203	0.3792	0.5745
Echinococcus granulosus	histone deacetylase 3	0.0091	0.1379	0.2028
Echinococcus multilocularis	DNA (apurinic or apyrimidinic site) lyase	0.0037	0.0205	0.0269
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0425	0.0425
Brugia malayi	RNA binding protein	0.0203	0.3792	0.378
Echinococcus multilocularis	tumor protein p63	0.0337	0.6696	1
Trypanosoma cruzi	histone deacetylase, putative	0.0047	0.0425	0.1869
Plasmodium vivax	histone deacetylase 1, putative	0.0091	0.1379	1
Echinococcus multilocularis	Ataxin 2, N terminal,domain containing protein	0.0034	0.0139	0.017
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0045	0.0388	0.037
Trichomonas vaginalis	histone deacetylase 1, 2 ,3, putative	0.0091	0.1379	0.2546
Trichomonas vaginalis	neutral alpha-glucosidase ab precursor, putative	0.0039	0.0258	0.0115
Trichomonas vaginalis	alpha-glucosidase, putative	0.0039	0.0258	0.0115
Trichomonas vaginalis	histone deacetylase 1, 2 ,3, putative	0.0091	0.1379	0.2546
Brugia malayi	hypothetical protein	0.0147	0.2577	0.2563
Echinococcus multilocularis	lysosomal alpha glucosidase	0.0177	0.3235	0.4811
Entamoeba histolytica	glycosyl hydrolase, family 31 protein	0.0039	0.0258	0.066
Echinococcus multilocularis	mothers against decapentaplegic 5	0.0033	0.0131	0.0157
Loa Loa (eye worm)	RNA binding protein	0.0203	0.3792	0.3792
Trypanosoma cruzi	PAB1-binding protein , putative	0.0075	0.1037	0.7087
Trichomonas vaginalis	myo inositol monophosphatase, putative	0.0038	0.0239	0.0073
Onchocerca volvulus	Glucosylceramidase homolog	0.0164	0.2955	1
Schistosoma mansoni	smad1 5 8 and	0.0033	0.0131	0.016
Schistosoma mansoni	gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2	0.0149	0.2636	0.3982
Trichomonas vaginalis	alpha-glucosidase, putative	0.0039	0.0258	0.0115
Plasmodium falciparum	histone deacetylase, putative	0.0074	0.1015	0.7313
Toxoplasma gondii	LsmAD domain-containing protein	0.0075	0.1037	0.7473
Mycobacterium ulcerans	lipase LipD	0.0071	0.0935	1
Schistosoma mansoni	hypothetical protein	0.0305	0.5995	0.9106
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0071	0.0935	0.1362
Brugia malayi	Glycosyl hydrolases family 31 protein	0.0177	0.3235	0.3222
Echinococcus granulosus	tumor protein p63	0.0337	0.6696	1
Brugia malayi	O-Glycosyl hydrolase family 30 protein	0.025	0.4814	0.4804
Loa Loa (eye worm)	hypothetical protein	0.007	0.0919	0.0919
Schistosoma mansoni	transcription factor LCR-F1	0.0036	0.0179	0.0233
Plasmodium vivax	histone deacetylase, putative	0.0047	0.0425	0.2946
Trichomonas vaginalis	glucosylceramidase, putative	0.0164	0.2955	0.5967
Trypanosoma cruzi	histone deacetylase 1, putative	0.0091	0.1379	1
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0045	0.0388	0.0542
Toxoplasma gondii	exonuclease III APE	0.0037	0.0205	0.1325
Trichomonas vaginalis	D-aminoacylase, putative	0.0071	0.0935	0.1582
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0094	0.1439	0.2117
Loa Loa (eye worm)	TAR-binding protein	0.0203	0.3792	0.3792
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0229	0.0229
Toxoplasma gondii	ABC1 family protein	0.0071	0.0935	0.6716
Echinococcus multilocularis	inositol monophosphatase 1	0.0038	0.0239	0.0319
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0297	0.5822	0.5814
Plasmodium vivax	histone deacetylase, putative	0.0074	0.1015	0.7313
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0036	0.0179	0.0229
Trichomonas vaginalis	histone deacetylase 1, 2 ,3, putative	0.0091	0.1379	0.2546
Echinococcus multilocularis	neutral alpha glucosidase AB	0.0039	0.0258	0.0348
Trichomonas vaginalis	glucosylceramidase, putative	0.0164	0.2955	0.5967
Brugia malayi	histone deacetylase 11	0.0047	0.0425	0.0406
Trypanosoma cruzi	hypothetical protein, conserved	0.0071	0.0935	0.6215
Trichomonas vaginalis	glucosylceramidase, putative	0.025	0.4814	1
Echinococcus multilocularis	smad	0.0033	0.0131	0.0157
Echinococcus multilocularis	histone deacetylase 3	0.0091	0.1379	0.2028
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.0388	0.0552
Loa Loa (eye worm)	hypothetical protein	0.0071	0.0935	0.0935
Loa Loa (eye worm)	hypothetical protein	0.0071	0.0935	0.0935
Brugia malayi	latrophilin 2 splice variant baaae	0.0203	0.3793	0.3782
Trypanosoma cruzi	hypothetical protein, conserved	0.0039	0.0258	0.0451
Onchocerca volvulus		0.0071	0.0935	0.2015
Trichomonas vaginalis	alpha-glucosidase, putative	0.0039	0.0258	0.0115
Trichomonas vaginalis	neutral alpha-glucosidase ab precursor, putative	0.0039	0.0258	0.0115
Schistosoma mansoni	smad1 5 8 and	0.0033	0.0131	0.016
Trichomonas vaginalis	maltase-glucoamylase, putative	0.0039	0.0258	0.0115
Schistosoma mansoni	smad1 5 8 and	0.0033	0.0131	0.016
Toxoplasma gondii	histone deacetylase HDAC4	0.0047	0.0425	0.2946
Schistosoma mansoni	hypothetical protein	0.0203	0.3793	0.5748
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0071	0.0935	0.1386
Mycobacterium tuberculosis	Conserved protein	0.0071	0.0935	0.0869
Trypanosoma brucei	PAB1-binding protein , putative	0.0075	0.1037	0.7473
Schistosoma mansoni	hypothetical protein	0.0036	0.0179	0.0233
Loa Loa (eye worm)	hypothetical protein	0.0046	0.0398	0.0398
Brugia malayi	TAR-binding protein	0.0203	0.3792	0.378
Echinococcus granulosus	histone acetyltransferase KAT2B	0.0046	0.0394	0.0551
Trichomonas vaginalis	glucosylceramidase, putative	0.0173	0.3146	0.6382
Brugia malayi	Bromodomain containing protein	0.0078	0.1088	0.1071
Echinococcus granulosus	smad	0.0033	0.0131	0.0157
Leishmania major	histone deacetylase, putative	0.0091	0.1379	1
Echinococcus granulosus	DNA apurinic or apyrimidinic site lyase	0.0037	0.0205	0.0269
Brugia malayi	Importin beta-1 subunit	0.0029	0.0026	0.0007
Loa Loa (eye worm)	histone deacetylase 1	0.0091	0.1379	0.1379
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0094	0.1439	0.2117
Schistosoma mansoni	hypothetical protein	0.0034	0.0139	0.0173
Trichomonas vaginalis	cat eye syndrome critical region protein 2, cscr2, putative	0.0046	0.0394	0.0409
Trichomonas vaginalis	histone deacetylase, putative	0.0091	0.1379	0.2546
Trypanosoma brucei	apurinic/apyrimidinic endonuclease, putative	0.0037	0.0205	0.1325
Brugia malayi	Histone deacetylase family protein	0.0074	0.1015	0.0998
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0045	0.0388	0.0542
Loa Loa (eye worm)	histone deacetylase 7A	0.0074	0.1015	0.1015
Loa Loa (eye worm)	cytochrome P450 family protein	0.0051	0.0505	0.0505
Loa Loa (eye worm)	acetyltransferase	0.0149	0.2636	0.2636
Loa Loa (eye worm)	MH1 domain-containing protein	0.0033	0.0131	0.0131
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0046	0.0394	0.0409
Trichomonas vaginalis	esterase, putative	0.0071	0.0935	0.1582
Plasmodium vivax	histone deacetylase 2, putative	0.0074	0.1015	0.7313
Echinococcus multilocularis	histone deacetylase 6	0.008	0.1145	0.1677
Toxoplasma gondii	histone lysine acetyltransferase GCN5-A	0.0046	0.0394	0.272
Echinococcus multilocularis	TGF beta signal transducer SmadC	0.0033	0.0131	0.0157
Trypanosoma cruzi	hypothetical protein, conserved	0.0039	0.0258	0.0451
Echinococcus multilocularis	histone deacetylase 6	0.0074	0.1015	0.1483
Trypanosoma cruzi	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0038	0.0239	0.0286
Brugia malayi	hypothetical protein	0.0049	0.046	0.0442
Brugia malayi	hypothetical protein	0.0036	0.0179	0.016
Toxoplasma gondii	histone lysine acetyltransferase GCN5-B	0.0046	0.0394	0.272
Trichomonas vaginalis	glucosylceramidase, putative	0.025	0.4814	1
Echinococcus multilocularis	tar DNA binding protein	0.0203	0.3792	0.5646
Echinococcus granulosus	mothers against decapentaplegic 5	0.0033	0.0131	0.0157
Schistosoma mansoni	hypothetical protein	0.0094	0.1439	0.2155
Schistosoma mansoni	ap endonuclease	0.0037	0.0205	0.0273
Brugia malayi	exodeoxyribonuclease III family protein	0.0037	0.0205	0.0187
Trypanosoma cruzi	PAB1-binding protein , putative	0.0075	0.1037	0.7087
Plasmodium falciparum	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0037	0.0205	0.1325
Trichomonas vaginalis	glucosylceramidase, putative	0.025	0.4814	1
Toxoplasma gondii	histone deacetylase HDAC2	0.0091	0.1379	1
Schistosoma mansoni	histone deacetylase 4 5	0.0074	0.1015	0.1509
Loa Loa (eye worm)	nucleolar RNA-associated protein alpha	0.0305	0.5995	0.5995
Mycobacterium tuberculosis	Probable lipase LipD	0.0071	0.0935	0.0869
Schistosoma mansoni	alpha-glucosidase	0.0152	0.2702	0.4083
Trypanosoma cruzi	histone deacetylase, putative	0.0047	0.0425	0.1869
Loa Loa (eye worm)	transcription factor SMAD2	0.049	1	1
Schistosoma mansoni	bromodomain containing protein	0.0066	0.0838	0.1238
Giardia lamblia	Histone deacetylase	0.0091	0.1379	1
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.0388	0.0552
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0297	0.5822	0.5822
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0036	0.0179	0.0229
Brugia malayi	Latrophilin receptor protein 2	0.0094	0.1439	0.1422
Echinococcus granulosus	histone acetyltransferase KAT2B	0.0143	0.2497	0.3704
Trichomonas vaginalis	glucosylceramidase, putative	0.0173	0.3146	0.6382
Leishmania major	histone deacetylase, putative	0.0074	0.1015	0.6902
Mycobacterium ulcerans	beta-lactamase	0.0071	0.0935	1
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0071	0.0935	0.0917
Leishmania major	histone deacetylase, putative	0.0091	0.1379	1
Toxoplasma gondii	glycosyl hydrolase, family 31 protein	0.0039	0.0258	0.1716
Brugia malayi	Inositol-1	0.0038	0.0239	0.022
Entamoeba histolytica	histone deacetylase, putative	0.0091	0.1379	1
Plasmodium falciparum	ataxin-2 like protein, putative	0.0075	0.1037	0.7473
Echinococcus multilocularis	histone deacetylase 1	0.0091	0.1379	0.2028
Onchocerca volvulus		0.0049	0.0476	0.0202
Trypanosoma cruzi	histone deacetylase, putative	0.0074	0.1015	0.6902
Echinococcus granulosus	histone deacetylase 8	0.0047	0.0425	0.0597
Brugia malayi	histone deacetylase 1 (HD1)	0.0091	0.1379	0.1362
Loa Loa (eye worm)	Smad1	0.0033	0.0131	0.0131
Trichomonas vaginalis	glucosylceramidase, putative	0.0164	0.2955	0.5967
Mycobacterium tuberculosis	Probable lipase LipE	0.0071	0.0935	0.0869
Schistosoma mansoni	alpha-glucosidase	0.0152	0.2702	0.4083
Loa Loa (eye worm)	hypothetical protein	0.0075	0.1037	0.1037
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0094	0.1439	0.2117
Schistosoma mansoni	inositol monophosphatase	0.0038	0.0239	0.0325
Entamoeba histolytica	glycosyl hydrolase, family 31 protein	0.0039	0.0258	0.066
Schistosoma mansoni	inositol monophosphatase	0.0038	0.0239	0.0325
Loa Loa (eye worm)	glycosyl hydrolase family 31 protein	0.0177	0.3235	0.3235
Echinococcus granulosus	snurportin 1	0.0305	0.5995	0.8949
Echinococcus granulosus	GPCR family 2	0.0094	0.1439	0.2117
Schistosoma mansoni	histone deacetylase	0.0091	0.1379	0.2063
Onchocerca volvulus		0.0102	0.1622	0.4731
Echinococcus multilocularis	lysosomal alpha glucosidase	0.0177	0.3235	0.4811
Loa Loa (eye worm)	histone deacetylase 11	0.0047	0.0425	0.0425
Brugia malayi	Bromodomain containing protein	0.0041	0.0305	0.0286
Plasmodium vivax	histone acetyltransferase GCN5, putative	0.0046	0.0394	0.272
Brugia malayi	beta-lactamase family protein	0.0071	0.0935	0.0917
Echinococcus granulosus	bromodomain adjacent to zinc finger domain	0.0036	0.0176	0.0225
Mycobacterium tuberculosis	Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI)	0.0037	0.0205	0.0059
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0071	0.0935	0.1386
Loa Loa (eye worm)	inositol-1	0.0038	0.0239	0.0239
Echinococcus granulosus	histone deacetylase 6	0.0074	0.1015	0.1483
Echinococcus granulosus	geminin	0.0332	0.658	0.9827
Schistosoma mansoni	histone deacetylase	0.0091	0.1379	0.2063
Brugia malayi	MH1 domain containing protein	0.0033	0.0131	0.0112
Toxoplasma gondii	histone deacetylase HDAC1	0.0074	0.1015	0.7313
Plasmodium falciparum	histone deacetylase 2	0.0074	0.1015	0.7313
Loa Loa (eye worm)	hypothetical protein	0.0071	0.0935	0.0935
Echinococcus granulosus	TGF beta signal transducer SmadC	0.0033	0.0131	0.0157

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	19.9526 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of binding or entry into cells for Lassa Virus. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID463114, AID540249]	ChEMBL.	No reference
Potency (functional)	= 31.6228 um	PUBCHEM_BIOASSAY: Counterscreen qHTS for Inhibitors of Tau Fibril Formation, Fluorescence Polarization. This assay monitors tau fibrillation by fluorescence polarization (FP) of Alexa 594-labeled K18 P301L, which does not fibrillize readily but incorporates into growing filaments of unlabeled tau. (Class of assay: confirmatory) [Related pubchem assays: 596 ]	ChEMBL.	No reference
Potency (functional)	39.8107 uM	PubChem BioAssay. qHTS of PTHR Inhibitors: Primary Screen. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	89.1251 uM	PubChem BioAssay. qHTS Assay to Find Inhibitors of Pin1. (Class of assay: confirmatory)	ChEMBL.	No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Homo sapiens	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: CHEMBL1356589

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1207174