TDR Targets

Basic information

Technical information

TDR Targets ID: 1288542
Name: N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[[5-[[(4- methoxyphenyl)amino]methyl]-4-methyl-1,2,4-tr iazol-3-yl]sulfanyl]acetamide
MW: 419.524 | Formula: C17H21N7O2S2
H donors: 2 H acceptors: 5 LogP: 2.27 Rotable bonds: 10
Rule of 5 violations (Lipinski): 1
SMILES: CCc1nnc(s1)NC(=O)CSc1nnc(n1C)CNc1ccc(cc1)OC
InChi: 1S/C17H21N7O2S2/c1-4-15-21-22-16(28-15)19-14(25)10-27-17-23-20-13(24(17)2)9-18-11-5-7-12(26-3)8-6-11/h5-8,18H,4,9-10H2,1-3H3,(H,19,22,25)
InChiKey: LQPPLQKYPDWKGF-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

N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[[5-[[(4-methoxyphenyl)amino]methyl]-4-methyl-1,2,4-triazol-3-yl]thio]acetamide
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[[5-[[(4-methoxyphenyl)amino]methyl]-4-methyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide
MLS000698928
N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-({5-[(4-methoxyanilino)methyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide
SMR000226367
Oprea1_059429
Oprea1_562088

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	glutaminase	Starlite/ChEMBL	No references
Homo sapiens	lamin A/C	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Echinococcus granulosus	lamin dm0	Get druggable targets OG5_128723	All targets in OG5_128723
Onchocerca volvulus		Get druggable targets OG5_128723	All targets in OG5_128723
Schistosoma mansoni	lamin	Get druggable targets OG5_128723	All targets in OG5_128723
Schistosoma japonicum	expressed protein	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)	hypothetical protein	Get druggable targets OG5_128723	All targets in OG5_128723
Schistosoma japonicum	Intermediate filament protein ifa-1, putative	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
Mycobacterium ulcerans	glutaminase	Get druggable targets OG5_129245	All targets in OG5_129245
Schistosoma japonicum	expressed protein	Get druggable targets OG5_128723	All targets in OG5_128723
Loa Loa (eye worm)	glutaminase	Get druggable targets OG5_129245	All targets in OG5_129245
Echinococcus granulosus	cytoplasmic intermediate filament protein	Get druggable targets OG5_128723	All targets in OG5_128723
Loa Loa (eye worm)	glutaminase 2	Get druggable targets OG5_129245	All targets in OG5_129245
Schistosoma japonicum	Lamin-C, putative	Get druggable targets OG5_128723	All targets in OG5_128723
Schistosoma mansoni	glutaminase	Get druggable targets OG5_129245	All targets in OG5_129245
Loa Loa (eye worm)	hypothetical 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
Schistosoma japonicum	ko:K07611 lamin, putative	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
Echinococcus multilocularis	cytoplasmic intermediate filament protein	Get druggable targets OG5_128723	All targets in OG5_128723
Trichomonas vaginalis	glutaminase, putative	Get druggable targets OG5_129245	All targets in OG5_129245
Echinococcus multilocularis	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)	hypothetical protein	Get druggable targets OG5_128723	All targets in OG5_128723
Echinococcus multilocularis	lamin dm0	Get druggable targets OG5_128723	All targets in OG5_128723
Echinococcus multilocularis	musashi	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
Loa Loa (eye worm)	intermediate filament protein	Get druggable targets OG5_128723	All targets in OG5_128723
Echinococcus granulosus	intermediate filament protein	Get druggable targets OG5_128723	All targets in OG5_128723
Echinococcus granulosus	lamin	Get druggable targets OG5_128723	All targets in OG5_128723
Schistosoma mansoni	lamin	Get druggable targets OG5_128723	All targets in OG5_128723
Brugia malayi	glutaminase DH11.1	Get druggable targets OG5_129245	All targets in OG5_129245
Onchocerca volvulus		Get druggable targets OG5_128723	All targets in OG5_128723

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 granulosus	inositol monophosphatase 1	0.0036	0.0275	0.0273
Schistosoma mansoni	hypothetical protein	0.0047	0.0426	0.0934
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0028	0.0152	0.0227
Brugia malayi	Intermediate filament tail domain containing protein	0.0033	0.0221	0.0484
Loa Loa (eye worm)	glutaminase	0.033	0.4543	1
Trypanosoma cruzi	target of rapamycin kinase 3	0.0074	0.0816	0.2577
Schistosoma mansoni	hypothetical protein	0.0047	0.0426	0.0934
Trichomonas vaginalis	PIKK family atypical protein kinase	0.005	0.0472	0.1037
Loa Loa (eye worm)	hypothetical protein	0.0103	0.1248	0.2747
Schistosoma mansoni	scm-relatedprotein containing 4 mbt domains (sfmbt)	0.0048	0.045	0.0988
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0089	0.1043	0.2292
Brugia malayi	Iron-sulfur cluster assembly accessory protein	0.0049	0.0458	0.1006
Onchocerca volvulus		0.0103	0.1248	1
Echinococcus multilocularis	GPCR, family 2	0.0047	0.0426	0.0424
Loa Loa (eye worm)	intermediate filament protein	0.0033	0.0221	0.0486
Brugia malayi	hypothetical protein	0.024	0.3231	0.7111
Echinococcus multilocularis	musashi	0.0033	0.0221	0.0219
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0074	0.0815	0.1792
Loa Loa (eye worm)	hypothetical protein	0.0042	0.0357	0.0786
Trypanosoma brucei	phosphatidylinositol 4-kinase, putative	0.0092	0.109	0.3442
Trypanosoma cruzi	cruzipain precursor, putative	0.0062	0.0653	0.206
Trichomonas vaginalis	PIKK family atypical protein kinase	0.005	0.0472	0.1037
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0092	0.109	0.2398
Entamoeba histolytica	phosphatidylinositol3-kinaseTor2, putative	0.0092	0.109	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0069	0.0746	0.1639
Trichomonas vaginalis	PIKK family atypical protein kinase	0.005	0.0472	0.1037
Leishmania major	target of rapamycin (TOR) kinase 2, putative	0.0092	0.109	0.3115
Loa Loa (eye worm)	hypothetical protein	0.0235	0.3164	0.6964
Echinococcus multilocularis	lamin dm0	0.0033	0.0221	0.0219
Onchocerca volvulus		0.0048	0.045	0.2722
Echinococcus multilocularis	fetal alzheimer antigen, falz	0.0022	0.007	0.0068
Echinococcus granulosus	zinc finger protein	0.0019	0.0027	0.0026
Schistosoma mansoni	phosphatidylinositol 3-and 4-kinase	0.0031	0.0198	0.0432
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0031	0.0198	0.0432
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0062	0.0653	0.206
Onchocerca volvulus		0.0049	0.0458	0.2794
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0055	0.0542	0.119
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0055	0.055	0.1207
Leishmania major	cathepsin L-like protease	0.0062	0.0653	0.1664
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0031	0.0198	0.0432
Leishmania major	phosphatidylinositol 3-kinase, putative	0.0031	0.0198	0.0153
Trichomonas vaginalis	myo inositol monophosphatase, putative	0.0036	0.0275	0.0602
Brugia malayi	Bromodomain containing protein	0.0038	0.0295	0.0647
Echinococcus granulosus	fetal alzheimer antigen falz	0.0022	0.007	0.0068
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0092	0.109	0.2397
Onchocerca volvulus	Polycomb protein Sfmbt homolog	0.0048	0.045	0.2722
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0069	0.0746	0.1639
Plasmodium vivax	ataxin-2 like protein, putative	0.0235	0.3164	1
Trypanosoma cruzi	cysteine peptidase, putative	0.0062	0.0653	0.206
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0055	0.055	0.1207
Loa Loa (eye worm)	hypothetical protein	0.004	0.033	0.0726
Schistosoma mansoni	sex comb on midleg homolog	0.0048	0.045	0.0988
Toxoplasma gondii	non-specific serine/threonine protein kinase	0.0019	0.003	0.0092
Brugia malayi	intermediate filament protein	0.0033	0.0221	0.0484
Giardia lamblia	GTOR	0.0092	0.109	0.5
Trypanosoma cruzi	major cysteine proteinase, putative	0.0049	0.0459	0.1447
Schistosoma mansoni	hypothetical protein	0.0101	0.1213	0.2667
Trypanosoma cruzi	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0036	0.0275	0.0865
Echinococcus multilocularis	histone acetyltransferase MYST2	0.0055	0.0548	0.0546
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0074	0.0815	0.1792
Brugia malayi	hypothetical protein	0.0152	0.1953	0.4298
Loa Loa (eye worm)	hypothetical protein	0.0021	0.005	0.0109
Loa Loa (eye worm)	hypothetical protein	0.0021	0.005	0.0109
Echinococcus multilocularis	endonuclease exonuclease phosphatase	0.0191	0.2517	0.2516
Entamoeba histolytica	acyl-coA synthetase, putative	0.0028	0.0152	0.1381
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0089	0.1043	0.2295
Brugia malayi	Latrophilin receptor protein 2	0.0047	0.0426	0.0935
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0047	0.0426	0.0424
Echinococcus granulosus	suppression of tumorigenicity 18 protein	0.0055	0.0548	0.0546
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.0057	0.0574	0.1811
Schistosoma mansoni	intermediate filament proteins	0.0033	0.0221	0.0483
Trichomonas vaginalis	PIKK family atypical protein kinase	0.005	0.0471	0.1035
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0047	0.0426	0.0424
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0055	0.055	0.1207
Brugia malayi	Bromodomain containing protein	0.0074	0.0819	0.1802
Echinococcus multilocularis	phosphatidylinositol 3 and 4 kinase	0.0031	0.0198	0.0196
Onchocerca volvulus		0.0033	0.0221	0.0628
Leishmania major	hypothetical protein, conserved	0.0235	0.3164	1
Loa Loa (eye worm)	hypothetical protein	0.024	0.3231	0.7112
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0031	0.0198	0.0432
Schistosoma mansoni	hypothetical protein	0.002	0.0042	0.009
Echinococcus granulosus	phosphatidylinositol 3 and 4 kinase	0.0031	0.0198	0.0196
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0055	0.0542	0.119
Wolbachia endosymbiont of Brugia malayi	fructose-1,6-bisphosphatase	0.0036	0.0275	0.5
Mycobacterium leprae	possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ).	0.0032	0.022	1
Schistosoma mansoni	glutaminase	0.033	0.4543	1
Brugia malayi	Inositol-1	0.0036	0.0275	0.0603
Schistosoma mansoni	ataxia telangiectasia mutated (atm)-related	0.0092	0.109	0.2397
Mycobacterium ulcerans	acyl-CoA synthetase	0.0028	0.0152	0.0227
Mycobacterium tuberculosis	Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase)	0.0028	0.0152	0.6363
Toxoplasma gondii	target of rapamycin (TOR), putative	0.0069	0.0746	0.2354
Brugia malayi	AMP-binding enzyme family protein	0.0028	0.0152	0.0332
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0047	0.0426	0.0424
Entamoeba histolytica	myo-inositol monophosphatase, putative	0.0036	0.0275	0.2512
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0001	0.0003
Echinococcus granulosus	lamin	0.0033	0.0221	0.0219
Mycobacterium tuberculosis	Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.0021	0.005	0.0884
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0047	0.0426	0.0935
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0148	0.1891	0.4161
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0062	0.0653	0.206
Echinococcus multilocularis	inositol monophosphatase 1	0.0036	0.0275	0.0273
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0062	0.0653	0.206
Leishmania major	cathepsin L-like protease	0.0062	0.0653	0.1664
Echinococcus multilocularis	lamin	0.0033	0.0221	0.0219
Loa Loa (eye worm)	hypothetical protein	0.0055	0.0548	0.1205
Brugia malayi	glutaminase DH11.1	0.033	0.4543	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.005	0.0472	0.1037
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0089	0.1043	0.1041
Trichomonas vaginalis	PIKK family atypical protein kinase	0.005	0.0471	0.1035
Trypanosoma brucei	PAB1-binding protein , putative	0.0235	0.3164	1
Echinococcus granulosus	survival motor neuron protein 1	0.024	0.3231	0.323
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0017	0.0001	0.0001
Leishmania major	cathepsin L-like protease	0.0062	0.0653	0.1664
Echinococcus granulosus	bromodomain adjacent to zinc finger domain	0.0059	0.0601	0.0599
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0089	0.1043	0.1041
Trypanosoma brucei	phosphatidylinositol 3-related kinase, putative	0.0031	0.0198	0.0621
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0031	0.0198	0.0432
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0212	0.0467
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0047	0.0426	0.0937
Echinococcus granulosus	endonuclease exonuclease phosphatase	0.0191	0.2517	0.2516
Schistosoma mansoni	lamin	0.0033	0.0221	0.0483
Brugia malayi	MH2 domain containing protein	0.0238	0.3205	0.7055
Trypanosoma cruzi	PAB1-binding protein , putative	0.0235	0.3164	1
Mycobacterium ulcerans	extragenic suppressor protein SuhB	0.0036	0.0275	0.0501
Mycobacterium ulcerans	glutaminase	0.033	0.4543	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.006	0.0619	0.136
Schistosoma mansoni	bromodomain containing protein	0.0062	0.0652	0.1432
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0062	0.0653	0.206
Echinococcus multilocularis	polycomb protein SCMH1	0.0048	0.045	0.0449
Brugia malayi	AMP-binding enzyme family protein	0.0028	0.0152	0.0332
Trypanosoma cruzi	phosphatidylinositol 3-related kinase, putative	0.0031	0.0198	0.0621
Echinococcus multilocularis	SAM and MBT domain containing protein	0.0048	0.045	0.0449
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0031	0.0198	0.0433
Onchocerca volvulus		0.0033	0.0221	0.0628
Echinococcus multilocularis	survival motor neuron protein 1	0.024	0.3231	0.323
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0047	0.0426	0.0424
Leishmania major	target of rapamycin kinase (TOR) kinase 3	0.0074	0.0816	0.2207
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0074	0.0815	0.1792
Loa Loa (eye worm)	inositol-1	0.0036	0.0275	0.0605
Schistosoma mansoni	hypothetical protein	0.0105	0.128	0.2815
Plasmodium falciparum	ataxin-2 like protein, putative	0.0235	0.3164	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0074	0.0815	0.1792
Echinococcus multilocularis	bromodomain adjacent to zinc finger domain	0.0035	0.0261	0.026
Mycobacterium ulcerans	long-chain-fatty-acid-CoA ligase	0.0028	0.0152	0.0227
Loa Loa (eye worm)	phosphatidylinositol 3	0.0092	0.109	0.2399
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0062	0.0653	0.206
Trypanosoma brucei	FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative	0.0038	0.0305	0.096
Trypanosoma brucei	Phosphatidylinositol 3-kinase tor1	0.0092	0.109	0.3442
Brugia malayi	PHD-finger family protein	0.0025	0.0104	0.0226
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0062	0.0653	0.206
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0148	0.1891	0.4162
Echinococcus granulosus	GPCR family 2	0.0047	0.0426	0.0424
Loa Loa (eye worm)	cytoplasmic intermediate filament protein	0.0017	0.0001	0.0002
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0069	0.0746	0.1639
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0089	0.1043	0.1041
Mycobacterium ulcerans	hypothetical protein	0.0028	0.0152	0.0227
Schistosoma mansoni	hypothetical protein	0.0049	0.0458	0.1005
Schistosoma mansoni	inositol monophosphatase	0.0036	0.0275	0.0602
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0062	0.0653	0.206
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0089	0.1043	0.2292
Echinococcus multilocularis	zinc finger protein	0.0019	0.0027	0.0026
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0062	0.0653	0.206
Trichomonas vaginalis	inositol monophosphatase, putative	0.0036	0.0275	0.0602
Loa Loa (eye worm)	phosphatidylinositol 3	0.0031	0.0198	0.0435
Echinococcus granulosus	histone acetyltransferase MYST2	0.0055	0.0548	0.0546
Trichomonas vaginalis	conserved hypothetical protein	0.0019	0.003	0.0064
Entamoeba histolytica	FKBP-rapamycin associated protein (FRAP), putative	0.0092	0.109	1
Echinococcus granulosus	SAM and MBT domain containing protein	0.0048	0.045	0.0449
Loa Loa (eye worm)	MH2 domain-containing protein	0.0238	0.3205	0.7056
Loa Loa (eye worm)	hypothetical protein	0.0048	0.045	0.0991
Trypanosoma brucei	phosphatidylinositol 3-kinase, putative	0.0031	0.0198	0.0621
Loa Loa (eye worm)	PHD-finger family protein	0.002	0.0042	0.0093
Loa Loa (eye worm)	hypothetical protein	0.0019	0.003	0.0067
Trichomonas vaginalis	glutaminase, putative	0.033	0.4543	1
Schistosoma mansoni	hypothetical protein	0.0047	0.0426	0.0934
Loa Loa (eye worm)	hypothetical protein	0.0021	0.005	0.0109
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0017	0.0001	0.0001
Schistosoma mansoni	acetyl-CoA C-acetyltransferase	0.0022	0.007	0.015
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0062	0.0653	0.206
Loa Loa (eye worm)	mbt repeat family protein	0.0048	0.045	0.0991
Leishmania major	target of rapamycin (TOR) kinase 1, putative	0.0092	0.109	0.3115
Leishmania major	phosphatidylinositol 3-related kinase, putative	0.0031	0.0198	0.0153
Loa Loa (eye worm)	MBCTL1	0.0055	0.0548	0.1205
Loa Loa (eye worm)	hypothetical protein	0.0101	0.1213	0.267
Trypanosoma cruzi	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0036	0.0275	0.0865
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0069	0.0746	0.1639
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0092	0.109	0.2397
Toxoplasma gondii	inositol(myo)-1(or 4)-monophosphatase 2, putative	0.0036	0.0275	0.0865
Loa Loa (eye worm)	hypothetical protein	0.0021	0.005	0.0109
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0028	0.0152	0.6363
Brugia malayi	hypothetical protein	0.0235	0.3164	0.6963
Echinococcus granulosus	Ataxin 2 N terminaldomain containing protein	0.0105	0.128	0.1279
Schistosoma mansoni	hypothetical protein	0.0294	0.4019	0.8846
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0062	0.0648	0.1424
Mycobacterium ulcerans	long-chain-fatty-acid--CoA ligase	0.0028	0.0152	0.0227
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0148	0.1891	0.4161
Trypanosoma cruzi	phosphatidylinositol 3-related kinase, putative	0.0031	0.0198	0.0621
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0089	0.1043	0.2293
Trypanosoma cruzi	cysteine peptidase, putative	0.0062	0.0653	0.206
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0033	0.0221	0.0486
Trypanosoma brucei	target of rapamycin kinase 3, putative	0.0074	0.0816	0.2577
Trypanosoma cruzi	PAB1-binding protein , putative	0.0235	0.3164	1
Leishmania major	myo-inositol-1(or 4)-monophosphatase 1, putative	0.0036	0.0275	0.0409
Schistosoma mansoni	survival motor neuron protein	0.0049	0.0458	0.1005
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0069	0.0746	0.1639
Loa Loa (eye worm)	hypothetical protein	0.007	0.0758	0.1669
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0079	0.0894	0.1965
Echinococcus granulosus	FKBP12 rapamycin complex associated protein	0.0092	0.109	0.1089
Echinococcus multilocularis	Ataxin 2, N terminal,domain containing protein	0.0105	0.128	0.1279
Trypanosoma cruzi	cysteine peptidase, putative	0.0062	0.0653	0.206
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0074	0.0815	0.1792
Loa Loa (eye worm)	hypothetical protein	0.0021	0.005	0.0109
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0028	0.0152	0.1381
Schistosoma mansoni	zinc finger protein	0.0019	0.0027	0.0057
Mycobacterium ulcerans	long-chain fatty-acid CoA ligase	0.0028	0.0152	0.0227
Brugia malayi	C2-HC type zinc finger protein C.e-MyT1	0.0055	0.0548	0.1203
Mycobacterium ulcerans	acyl-CoA synthetase	0.0028	0.0152	0.0227
Echinococcus multilocularis	suppression of tumorigenicity 18 protein	0.0055	0.0548	0.0546
Loa Loa (eye worm)	transcription factor SMAD2	0.0238	0.3205	0.7056
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0092	0.109	0.2397
Schistosoma mansoni	cellular tumor antigen P53	0.0103	0.1248	0.2745
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0089	0.1043	0.2292
Echinococcus granulosus	polycomb protein SCMH1	0.0048	0.045	0.0449
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0296	0.0651
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0069	0.0746	0.1639
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0152	0.0334
Schistosoma mansoni	inositol monophosphatase	0.0036	0.0275	0.0602
Loa Loa (eye worm)	glutaminase 2	0.033	0.4543	1
Schistosoma mansoni	myelin transcription factor 1 myt1	0.0055	0.0548	0.1202
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0152	0.0334
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0021	0.0046
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor2	0.0092	0.109	0.3442
Brugia malayi	mbt repeat family protein	0.0048	0.045	0.0989
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0152	0.0334
Schistosoma mansoni	hypothetical protein	0.0047	0.0426	0.0934
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0062	0.0653	0.206
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0028	0.0152	0.1381
Schistosoma mansoni	lamin	0.0033	0.0221	0.0483
Brugia malayi	latrophilin 2 splice variant baaae	0.0101	0.1213	0.2668
Toxoplasma gondii	LsmAD domain-containing protein	0.0235	0.3164	1
Brugia malayi	mbt repeat family protein	0.0048	0.045	0.0989
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0025	0.0108	0.0234
Trichomonas vaginalis	PIKK family atypical protein kinase	0.005	0.0471	0.1035
Echinococcus granulosus	intermediate filament protein	0.0033	0.0221	0.0219
Mycobacterium tuberculosis	Inositol-1-monophosphatase SuhB	0.0032	0.022	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0031	0.0198	0.0432
Trichomonas vaginalis	myo inositol monophosphatase, putative	0.0036	0.0275	0.0602
Echinococcus multilocularis	FKBP12 rapamycin complex associated protein	0.0092	0.109	0.1089
Mycobacterium ulcerans	acyl-CoA synthetase	0.0028	0.0152	0.0227
Loa Loa (eye worm)	hypothetical protein	0.0148	0.1891	0.4162
Echinococcus granulosus	lamin dm0	0.0033	0.0221	0.0219
Echinococcus multilocularis	bromodomain adjacent to zinc finger domain	0.0059	0.0601	0.0599
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0426	0.0937
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor1	0.0092	0.109	0.3442
Echinococcus granulosus	bromodomain adjacent to zinc finger domain	0.0035	0.0261	0.026
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0069	0.0746	0.1639
Schistosoma mansoni	sex comb on midleg homolog	0.0048	0.045	0.0988
Chlamydia trachomatis	acylglycerophosphoethanolamine acyltransferase	0.0021	0.005	0.5
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0089	0.1043	0.1041
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0221	0.0486
Brugia malayi	AMP-binding enzyme family protein	0.0028	0.0152	0.0332
Trypanosoma brucei	phosphatidylinositol 3-kinase tor, putative	0.0044	0.0382	0.1205
Trypanosoma brucei	inositol-1(or 4)-monophosphatase 1, putative	0.0036	0.0275	0.0865
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0062	0.0653	0.206
Plasmodium falciparum	ataxin-2 like protein, putative	0.0235	0.3164	1

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	= 0.1413 um	PUBCHEM_BIOASSAY: qHTS Assay for Modulators of Lamin A Splicing. (Class of assay: confirmatory)	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 for Inhibitors of Glutaminase (GLS). (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	28.1838 uM	PubChem BioAssay. qHTS Assay for Inhibitors of Human alpha-Galactosidase at pH 4.5. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	100 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623]	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.

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External resources for this compound

ChEMBL: CHEMBL1392751

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1288542