TDR Targets

Basic information

Technical information

TDR Targets ID: 1344173
Name: butyl N-[5-[(4-chlorophenyl)methyl]-1,3,4-thi adiazol-2-yl]carbamate
MW: 325.814 | Formula: C14H16ClN3O2S
H donors: 1 H acceptors: 3 LogP: 4.12 Rotable bonds: 8
Rule of 5 violations (Lipinski): 1
SMILES: CCCCOC(=O)Nc1nnc(s1)Cc1ccc(cc1)Cl
InChi: 1S/C14H16ClN3O2S/c1-2-3-8-20-14(19)16-13-18-17-12(21-13)9-10-4-6-11(15)7-5-10/h4-7H,2-3,8-9H2,1H3,(H,16,18,19)
InChiKey: GJDNHSKMTWUSHC-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-[(4-chlorophenyl)methyl]-1,3,4-thiadiazol-2-yl]carbamic acid butyl ester
N-[5-(4-chlorobenzyl)-1,3,4-thiadiazol-2-yl]carbamic acid butyl ester
ZINC02912526
MLS000766049
SMR000279755
BAS 00641893
[5-(4-Chloro-benzyl)-[1,3,4]thiadiazol-2-yl]-carbamic acid butyl ester

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	survival of motor neuron 2, centromeric	Starlite/ChEMBL	No references
Homo sapiens	APEX nuclease (multifunctional DNA repair enzyme) 1	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Brugia malayi	exodeoxyribonuclease III family protein	Get druggable targets OG5_126768	All targets in OG5_126768
Schistosoma japonicum	DNA-(apurinic or apyrimidinic site) lyase 2, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Echinococcus multilocularis	survival motor neuron protein 1	Get druggable targets OG5_132873	All targets in OG5_132873
Toxoplasma gondii	exonuclease III APE	Get druggable targets OG5_126768	All targets in OG5_126768
Giardia lamblia	Endonuclease/Exonuclease/phosphatase	Get druggable targets OG5_126768	All targets in OG5_126768
Plasmodium berghei	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	Get druggable targets OG5_126768	All targets in OG5_126768
Cryptosporidium parvum	conserved hypothetical protein	Get druggable targets OG5_126768	All targets in OG5_126768
Brugia malayi	hypothetical protein	Get druggable targets OG5_132873	All targets in OG5_132873
Leishmania major	apurinic/apyrimidinic endonuclease-redox protein	Get druggable targets OG5_126768	All targets in OG5_126768
Cryptosporidium hominis	dna-(apurinic or apyrimidinic site) lyase	Get druggable targets OG5_126768	All targets in OG5_126768
Trichomonas vaginalis	ap endonuclease, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Candida albicans	similar to S. cerevisiae APN2 (YBL019W) DNA repair apurinic/apyrimidinic endonuclease	Get druggable targets OG5_126768	All targets in OG5_126768
Trypanosoma congolense	apurinic/apyrimidinic endonuclease, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Plasmodium yoelii	putative AP endonuclease-related	Get druggable targets OG5_126768	All targets in OG5_126768
Theileria parva	hypothetical protein	Get druggable targets OG5_126768	All targets in OG5_126768
Treponema pallidum	exodeoxyribonuclease (exoA)	Get druggable targets OG5_126768	All targets in OG5_126768
Plasmodium falciparum	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	Get druggable targets OG5_126768	All targets in OG5_126768
Plasmodium vivax	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	Get druggable targets OG5_126768	All targets in OG5_126768
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease	Get druggable targets OG5_126768	All targets in OG5_126768
Echinococcus granulosus	DNA apurinic or apyrimidinic site lyase	Get druggable targets OG5_126768	All targets in OG5_126768
Leishmania braziliensis	apurinic/apyrimidinic endonuclease-redox protein	Get druggable targets OG5_126768	All targets in OG5_126768
Leishmania donovani	apurinic/apyrimidinic endonuclease-redox protein	Get druggable targets OG5_126768	All targets in OG5_126768
Candida albicans	similar to S. cerevisiae APN2 (YBL019W) DNA repair apurinic/apyrimidinic endonuclease	Get druggable targets OG5_126768	All targets in OG5_126768
Schistosoma mansoni	ap endonuclease	Get druggable targets OG5_126768	All targets in OG5_126768
Mycobacterium ulcerans	exodeoxyribonuclease III protein XthA	Get druggable targets OG5_126768	All targets in OG5_126768
Schistosoma japonicum	ko:K10772 AP endonuclease 2, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_132873	All targets in OG5_132873
Echinococcus multilocularis	DNA (apurinic or apyrimidinic site) lyase	Get druggable targets OG5_126768	All targets in OG5_126768
Leishmania mexicana	apurinic/apyrimidinic endonuclease-redox protein,AP-endonuclease	Get druggable targets OG5_126768	All targets in OG5_126768
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	Get druggable targets OG5_126768	All targets in OG5_126768
Wolbachia endosymbiont of Brugia malayi	exonuclease III	Get druggable targets OG5_126768	All targets in OG5_126768
Neospora caninum	hypothetical protein	Get druggable targets OG5_126768	All targets in OG5_126768
Entamoeba histolytica	exodeoxyribonuclease III, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Schistosoma mansoni	ap endonuclease	Get druggable targets OG5_126768	All targets in OG5_126768
Plasmodium knowlesi	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	Get druggable targets OG5_126768	All targets in OG5_126768
Leishmania infantum	apurinic/apyrimidinic endonuclease-redox protein	Get druggable targets OG5_126768	All targets in OG5_126768
Echinococcus granulosus	survival motor neuron protein 1	Get druggable targets OG5_132873	All targets in OG5_132873
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Trypanosoma brucei gambiense	apurinic/apyrimidinic endonuclease, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Trichomonas vaginalis	ap endonuclease, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Schistosoma japonicum	DNA-(apurinic or apyrimidinic site) lyase 2, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Mycobacterium tuberculosis	Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI)	Get druggable targets OG5_126768	All targets in OG5_126768
Trypanosoma brucei	apurinic/apyrimidinic endonuclease, putative	Get druggable targets OG5_126768	All targets in OG5_126768
Schistosoma japonicum	ko:K10771 AP endonuclease 1, putative	Get druggable targets OG5_126768	All targets in OG5_126768

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
Trichomonas vaginalis	conserved hypothetical protein	0.0083	0.086	0.1155
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0396	0.0745
Echinococcus granulosus	single minded 2	0.0044	0.0363	0.0432
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0035	0.0251	0.0299
Echinococcus multilocularis	Niemann Pick C1 protein	0.0195	0.2265	0.2265
Plasmodium falciparum	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0023	0.009	0.3672
Mycobacterium tuberculosis	Probable lipase LipD	0.0035	0.0251	0.0624
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0063	0.0118
Schistosoma mansoni	tsg101-related	0.0046	0.0391	0.0466
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease, putative	0.0023	0.009	0.0746
Loa Loa (eye worm)	hypothetical protein	0.0195	0.2265	0.4265
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.009	0.0947	0.1129
Brugia malayi	Protein kinase domain containing protein	0.0407	0.4953	0.9324
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0019	0.0043	0.0354
Echinococcus granulosus	Aryl hydrocarbon receptor nuclear	0.0016	0.0006	0.0007
Trypanosoma cruzi	STE group serine/threonine-protein kinase, putative	0.0016	0.0009	0.0074
Brugia malayi	PAS domain containing protein	0.006	0.0559	0.1053
Leishmania major	UDP-galactopyranose mutase	0.0021	0.0063	0.0519
Brugia malayi	serine/threonine-protein kinase plk-2	0.0094	0.0996	0.1876
Leishmania major	4-coumarate:coa ligase-like protein	0.0047	0.0396	0.3271
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0246	0.0463
Trypanosoma brucei	polo-like protein kinase	0.0094	0.0996	0.8234
Echinococcus multilocularis	serine:threonine protein kinase PLK1	0.0094	0.0996	0.0996
Loa Loa (eye worm)	hypothetical protein	0.0435	0.5312	1
Giardia lamblia	Fructose-bisphosphate aldolase	0.0577	0.7113	1
Trypanosoma brucei	calpain-like cysteine peptidase, putative	0.0111	0.121	1
Mycobacterium ulcerans	acyl-CoA synthetase	0.0047	0.0396	0.1022
Echinococcus granulosus	lysine specific demethylase 5A	0.0058	0.0542	0.0647
Entamoeba histolytica	Niemann-Pick C1 protein, putative	0.0195	0.2265	0.3143
Trypanosoma brucei	calpain-like cysteine peptidase, putative	0.0111	0.121	1
Trypanosoma cruzi	calpain-like cysteine peptidase, putative	0.0111	0.121	1
Mycobacterium leprae	conserved hypothetical protein	0.0035	0.0251	0.0567
Trypanosoma cruzi	UDP-galactopyranose mutase	0.0021	0.0063	0.0519
Trichomonas vaginalis	penicillin-binding protein, putative	0.0035	0.0251	0.0294
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0035	0.0251	0.0251
Brugia malayi	beta-lactamase family protein	0.0035	0.0251	0.0472
Schistosoma mansoni	lozenge	0.0055	0.0494	0.0589
Entamoeba histolytica	serine/threonine protein kinase, putative	0.0094	0.0996	0.1349
Toxoplasma gondii	histone lysine-specific demethylase	0.0021	0.0063	0.2509
Trypanosoma brucei	calpain-like cysteine peptidase, putative	0.0111	0.121	1
Loa Loa (eye worm)	camk/mapkapk/mnk protein kinase	0.0407	0.4953	0.9324
Leishmania major	4-coumarate:coa ligase-like protein	0.0047	0.0396	0.3271
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0019	0.0043	0.0354
Mycobacterium tuberculosis	Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.0035	0.0246	0.061
Toxoplasma gondii	ABC1 family protein	0.0035	0.0251	1
Brugia malayi	bHLH-PAS transcription factor	0.0044	0.0363	0.0682
Mycobacterium ulcerans	hypothetical protein	0.0047	0.0396	0.1022
Trichomonas vaginalis	D-aminoacylase, putative	0.0035	0.0251	0.0294
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0043	0.0354
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0047	0.0396	0.0499
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.009	0.0947	0.0947
Leishmania major	4-coumarate:coa ligase-like protein	0.0047	0.0396	0.3271
Trichomonas vaginalis	D-aminoacylase, putative	0.0035	0.0251	0.0294
Brugia malayi	Niemann-Pick C1 protein precursor	0.0195	0.2265	0.4265
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	0.0577	0.7113	1
Leishmania major	protein kinase, putative,polo-like protein kinase, putative	0.0094	0.0996	0.8234
Leishmania major	DNA polymerase eta, putative	0.0019	0.0043	0.0354
Mycobacterium tuberculosis	Probable conserved lipoprotein	0.0035	0.0251	0.0624
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0031	0.0197	0.0197
Schistosoma mansoni	hypothetical protein	0.0031	0.0197	0.0235
Loa Loa (eye worm)	hypothetical protein	0.0286	0.3418	0.6435
Trypanosoma brucei	Vps23 core domain containing protein, putative	0.0022	0.0079	0.0656
Echinococcus multilocularis	lysine specific demethylase 5A	0.0058	0.0542	0.0542
Mycobacterium tuberculosis	Possible oxidoreductase	0.0021	0.0063	0.006
Brugia malayi	hypothetical protein	0.0068	0.0668	0.1257
Plasmodium falciparum	acyl-CoA synthetase	0.0035	0.0246	1
Leishmania major	DNA polymerase kappa, putative	0.0019	0.0043	0.0354
Echinococcus multilocularis	protein quaking	0.0027	0.0145	0.0145
Schistosoma mansoni	Protoporphyrinogen oxidase chloroplast/mitochondrial precursor	0.0021	0.0063	0.0075
Plasmodium vivax	hypothetical protein, conserved	0.0035	0.0251	1
Chlamydia trachomatis	acylglycerophosphoethanolamine acyltransferase	0.0035	0.0246	1
Mycobacterium ulcerans	exodeoxyribonuclease III protein XthA	0.0023	0.009	0.0138
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.009	0.0947	0.1783
Brugia malayi	beta-lactamase family protein	0.0035	0.0251	0.0472
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0033	0.0222	0.0537
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.009	0.0947	0.1129
Echinococcus granulosus	DNA apurinic or apyrimidinic site lyase	0.0023	0.009	0.0108
Trichomonas vaginalis	CAMK family protein kinase	0.0094	0.0996	0.1349
Schistosoma mansoni	hypothetical protein	0.0067	0.0655	0.0781
Mycobacterium ulcerans	flavin-containing monoamine oxidase AofH	0.0292	0.3496	1
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0031	0.0197	0.0197
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0058	0.0542	0.0647
Echinococcus granulosus	beta LACTamase domain containing family member	0.0035	0.0251	0.0299
Leishmania major	protein kinase, putative	0.0016	0.0009	0.0074
Trichomonas vaginalis	hypothetical protein	0.0033	0.0224	0.0256
Mycobacterium ulcerans	fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE	0.0035	0.0251	0.0602
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0058	0.0542	0.0647
Trypanosoma cruzi	STE/STE11 serine/threonine-protein kinase, putative	0.0016	0.0009	0.0074
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0021	0.0063	0.006
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0251	0.0472
Echinococcus multilocularis	muscleblind protein 1	0.0148	0.1681	0.1681
Echinococcus multilocularis	microtubule associated protein 2	0.0678	0.8385	0.8385
Entamoeba histolytica	acyl-coA synthetase, putative	0.0047	0.0396	0.0499
Onchocerca volvulus		0.0035	0.0251	0.0358
Leishmania major	calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative	0.0111	0.121	1
Loa Loa (eye worm)	hypothetical protein	0.0067	0.0655	0.1233
Schistosoma mansoni	hypothetical protein	0.008	0.0821	0.098
Brugia malayi	beta-lactamase	0.0035	0.0251	0.0472
Onchocerca volvulus		0.0045	0.0369	0.0583
Loa Loa (eye worm)	hypothetical protein	0.0148	0.1681	0.3165
Loa Loa (eye worm)	ImpB/MucB/SamB family protein	0.0019	0.0043	0.0081
Mycobacterium tuberculosis	Probable hydrolase	0.0035	0.0251	0.0624
Echinococcus granulosus	terminal deoxycytidyl transferase rev1	0.0019	0.0043	0.0051
Trypanosoma cruzi	polo-like protein kinase, putative	0.0094	0.0996	0.8234
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0246	0.0463
Trypanosoma brucei	cysteine peptidase, Clan CA, family C2, putative	0.0111	0.121	1
Brugia malayi	amine oxidase, flavin-containing family protein	0.0021	0.0063	0.0118
Schistosoma mansoni	hypothetical protein	0.008	0.0821	0.098
Schistosoma mansoni	jumonji domain containing protein	0.0058	0.0542	0.0647
Echinococcus granulosus	serine:threonine protein kinase PLK1	0.0094	0.0996	0.1188
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.009	0.0947	0.1129
Trichomonas vaginalis	CAMK family protein kinase	0.0094	0.0996	0.1349
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0577	0.7113	1
Mycobacterium tuberculosis	Probable fructose-bisphosphate aldolase Fba	0.0282	0.3374	1
Plasmodium vivax	hypothetical protein, conserved	0.0021	0.0063	0.2509
Echinococcus multilocularis	expressed conserved protein	0.0183	0.2116	0.2116
Toxoplasma gondii	histone lysine-specific demethylase LSD1/BHC110/KDMA1A	0.0021	0.0063	0.2509
Trypanosoma cruzi	calpain cysteine peptidase, putative	0.0111	0.121	1
Onchocerca volvulus		0.0035	0.0251	0.0358
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0035	0.0246	0.0588
Echinococcus granulosus	lysine specific histone demethylase 1A	0.0021	0.0063	0.0075
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0145	0.0273
Brugia malayi	exodeoxyribonuclease III family protein	0.0023	0.009	0.017
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0226	0.2664	0.7868
Echinococcus multilocularis	Aryl hydrocarbon receptor nuclear	0.0016	0.0006	0.0006
Brugia malayi	Muscleblind-like protein	0.0148	0.1681	0.3165
Loa Loa (eye worm)	hypothetical protein	0.0113	0.1233	0.2322
Brugia malayi	Temporarily assigned gene name protein 44	0.0027	0.0145	0.0273
Schistosoma mansoni	ap endonuclease	0.0023	0.009	0.0108
Loa Loa (eye worm)	aryl Hydrocarbon receptor Associated protein family member	0.0016	0.0006	0.0011
Echinococcus multilocularis	dna polymerase eta	0.0019	0.0043	0.0043
Echinococcus multilocularis	DNA (apurinic or apyrimidinic site) lyase	0.0023	0.009	0.009
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0246	0.0463
Echinococcus granulosus	microtubule associated protein 2	0.0678	0.8385	1
Leishmania major	DNA polymerase kappa, putative,DNA polymerase IV, putative	0.0019	0.0043	0.0354
Echinococcus multilocularis	Niemann Pick C1 protein	0.0278	0.3322	0.3322
Trichomonas vaginalis	CAMK family protein kinase	0.0094	0.0996	0.1349
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0035	0.0251	0.0472
Trichomonas vaginalis	ap endonuclease, putative	0.0023	0.009	0.0067
Loa Loa (eye worm)	PLK/PLK1 protein kinase	0.0094	0.0996	0.1876
Mycobacterium tuberculosis	Conserved protein	0.0035	0.0251	0.0624
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0043	0.0354
Mycobacterium ulcerans	protoporphyrinogen oxidase	0.0021	0.0063	0.0058
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0251	0.0472
Trichomonas vaginalis	CAMK family protein kinase	0.0094	0.0996	0.1349
Brugia malayi	latrophilin 2 splice variant baaae	0.0067	0.0655	0.1233
Brugia malayi	CHE-14 protein	0.0083	0.086	0.1618
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0019	0.0043	0.0354
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0043	0.0354
Leishmania major	apurinic/apyrimidinic endonuclease-redox protein	0.0023	0.009	0.0746
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0063	0.0118
Mycobacterium ulcerans	long-chain-fatty-acid--CoA ligase	0.0047	0.0396	0.1022
Brugia malayi	aryl hydrocarbon receptor AHR-1	0.0113	0.1233	0.2322
Echinococcus granulosus	dna polymerase kappa	0.0019	0.0043	0.0051
Brugia malayi	Latrophilin receptor protein 2	0.0031	0.0197	0.0371
Brugia malayi	MH2 domain containing protein	0.0117	0.1288	0.2424
Onchocerca volvulus		0.0129	0.143	0.2604
Trypanosoma cruzi	hypothetical protein, conserved	0.0035	0.0251	0.2071
Echinococcus multilocularis	protein patched	0.0083	0.086	0.086
Brugia malayi	hypothetical protein	0.0435	0.5312	1
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.009	0.0947	0.1129
Echinococcus granulosus	muscleblind protein	0.0148	0.1681	0.2005
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0031	0.0197	0.0235
Trichomonas vaginalis	CAMK family protein kinase	0.0094	0.0996	0.1349
Plasmodium falciparum	conserved Plasmodium protein, unknown function	0.0021	0.0063	0.2557
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0577	0.7113	1
Schistosoma mansoni	hypothetical protein	0.0058	0.054	0.0644
Mycobacterium ulcerans	beta-lactamase	0.0035	0.0251	0.0602
Giardia lamblia	Kinase, PLK	0.0094	0.0996	0.1349
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0577	0.7113	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0043	0.0354
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0063	0.0118
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0043	0.0354
Leishmania major	hypothetical protein, conserved	0.0035	0.0251	0.2071
Trichomonas vaginalis	CAMK family protein kinase	0.0047	0.0397	0.05
Plasmodium vivax	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0023	0.009	0.3603
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0047	0.0396	0.106
Mycobacterium ulcerans	hypothetical protein	0.0035	0.0251	0.0602
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0577	0.7113	1
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease	0.0023	0.009	0.0746
Brugia malayi	hypothetical protein	0.0027	0.0145	0.0273
Trypanosoma cruzi	calpain-like cysteine peptidase, putative	0.0111	0.121	1
Giardia lamblia	Endonuclease/Exonuclease/phosphatase	0.0023	0.009	0.0067
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0197	0.0371
Trypanosoma brucei	DNA polymerase IV, putative	0.0019	0.0043	0.0354
Loa Loa (eye worm)	hypothetical protein	0.0148	0.1681	0.3165
Schistosoma mansoni	microtubule-associated protein tau	0.0678	0.8385	1
Trypanosoma brucei	calpain-like cysteine peptidase, putative	0.0111	0.121	1
Mycobacterium ulcerans	putative regulatory protein	0.0044	0.0363	0.0926
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0251	0.0472
Trypanosoma brucei	calpain, putative	0.0111	0.121	1
Echinococcus granulosus	dna polymerase eta	0.0019	0.0043	0.0051
Echinococcus granulosus	lysine specific histone demethylase 1A	0.0021	0.0063	0.0075
Mycobacterium tuberculosis	Probable esterase LipL	0.0035	0.0251	0.0624
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0251	0.0472
Schistosoma mansoni	hypothetical protein	0.0027	0.0145	0.0173
Brugia malayi	jmjC domain containing protein	0.0058	0.0542	0.1021
Schistosoma mansoni	hypothetical protein	0.0031	0.0197	0.0235
Mycobacterium ulcerans	esterase/lipase LipP	0.0035	0.0251	0.0602
Loa Loa (eye worm)	jmjC domain-containing protein	0.0058	0.0542	0.1021
Onchocerca volvulus	Serine\/threonine kinase homolog	0.0094	0.0996	0.1779
Trichomonas vaginalis	CAMK family protein kinase	0.0047	0.0397	0.05
Leishmania major	protein kinase, putative	0.0016	0.0009	0.0074
Mycobacterium tuberculosis	Probable lipase LipE	0.0035	0.0251	0.0624
Plasmodium falciparum	lysine-specific histone demethylase 1, putative	0.0021	0.0063	0.2557
Schistosoma mansoni	aryl hydrocarbon receptor	0.0173	0.1996	0.238
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0031	0.0197	0.0235
Echinococcus granulosus	Transcription factor JmjC domain containing protein	0.0058	0.0542	0.0647
Mycobacterium ulcerans	fructose-bisphosphate aldolase	0.0282	0.3374	0.9647
Echinococcus multilocularis	muscleblind protein	0.0148	0.1681	0.1681
Schistosoma mansoni	hypothetical protein	0.0031	0.0197	0.0235
Schistosoma mansoni	tsg101-related	0.0057	0.0523	0.0624
Echinococcus multilocularis	aryl hydrocarbon receptor	0.0129	0.1436	0.1436
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0043	0.0354
Trypanosoma brucei	calpain-like cysteine peptidase, putative	0.0111	0.121	1
Brugia malayi	hypothetical protein	0.0286	0.3418	0.6435
Trichomonas vaginalis	D-aminoacylase, putative	0.0035	0.0251	0.0294
Echinococcus granulosus	protein quaking	0.0027	0.0145	0.0173
Toxoplasma gondii	exonuclease III APE	0.0023	0.009	0.3603
Echinococcus multilocularis	survival motor neuron protein 1	0.0286	0.3418	0.3418
Mycobacterium tuberculosis	Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI)	0.0023	0.009	0.0143
Trypanosoma brucei	calpain-like protein, putative	0.0111	0.121	1
Schistosoma mansoni	survival motor neuron protein	0.0058	0.054	0.0644
Schistosoma mansoni	tsg101-related	0.0057	0.0523	0.0624
Trypanosoma cruzi	calpain-like cysteine peptidase, putative	0.0111	0.121	1
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0033	0.0222	0.0537
Mycobacterium tuberculosis	Probable esterase/lipase LipP	0.0035	0.0251	0.0624
Loa Loa (eye worm)	hypothetical protein	0.0435	0.5312	1
Mycobacterium tuberculosis	Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase)	0.0047	0.0396	0.106
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0047	0.0396	0.0499
Schistosoma mansoni	kinase	0.0048	0.0412	0.0492
Brugia malayi	ImpB/MucB/SamB family protein	0.0019	0.0043	0.0081
Echinococcus multilocularis	dna polymerase kappa	0.0019	0.0043	0.0043
Echinococcus granulosus	GPCR family 2	0.0031	0.0197	0.0235
Plasmodium falciparum	protoporphyrinogen oxidase	0.0021	0.0063	0.2557
Trypanosoma cruzi	DNA polymerase eta, putative	0.0019	0.0043	0.0354
Echinococcus granulosus	Niemann Pick C1 protein	0.0195	0.2265	0.2701
Schistosoma mansoni	rab geranylgeranyl transferase alpha subunit	0.0019	0.0043	0.0051
Echinococcus multilocularis		0.0021	0.0063	0.0063
Brugia malayi	SWIRM domain containing protein	0.0021	0.0063	0.0118
Trypanosoma cruzi	STE/STE11 serine/threonine-protein kinase, putative	0.0016	0.0009	0.0074
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0033	0.0222	0.0537
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0043	0.0354
Loa Loa (eye worm)	hypothetical protein	0.0114	0.124	0.2334
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	0.0023	0.009	0.017
Schistosoma mansoni	serine/threonine protein kinase	0.0094	0.0996	0.1188
Onchocerca volvulus		0.0435	0.5312	1
Leishmania major	calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative	0.0111	0.121	1
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0246	0.0463
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.009	0.0947	0.1783
Brugia malayi	tumor suppressor.	0.0319	0.3847	0.7242
Trypanosoma brucei	apurinic/apyrimidinic endonuclease, putative	0.0023	0.009	0.0746
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.009	0.0947	0.1129
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0251	0.0472
Mycobacterium ulcerans	flavin-containing monoamine oxidase AofH	0.0292	0.3496	1
Onchocerca volvulus		0.0058	0.054	0.0909
Onchocerca volvulus		0.0047	0.0396	0.0634
Echinococcus granulosus	Niemann Pick C1 protein	0.0278	0.3322	0.3962
Loa Loa (eye worm)	transcription factor SMAD2	0.0117	0.1288	0.2424
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0043	0.0354
Plasmodium vivax	protoporphyrinogen oxidase, putative	0.0021	0.0063	0.2509
Echinococcus multilocularis	sterol regulatory element binding protein	0.0083	0.086	0.086
Echinococcus multilocularis	Protein lozenge	0.0055	0.0494	0.0494
Trichomonas vaginalis	ap endonuclease, putative	0.0023	0.009	0.0067
Echinococcus multilocularis	tumor susceptibility gene 101 protein	0.0068	0.0668	0.0668
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0043	0.0354
Schistosoma mansoni	single-minded	0.006	0.0559	0.0667
Trypanosoma brucei	DNA polymerase kappa, putative	0.0019	0.0043	0.0354
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0577	0.7113	1
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	0.0577	0.7113	1
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0019	0.0043	0.0354
Schistosoma mansoni	amine oxidase	0.0021	0.0063	0.0075
Trypanosoma cruzi	STE group serine/threonine-protein kinase, putative	0.0016	0.0009	0.0074
Mycobacterium tuberculosis	Conserved protein	0.0035	0.0251	0.0624
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0246	0.0463
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0577	0.7113	1
Trichomonas vaginalis	CAMK family protein kinase	0.0094	0.0996	0.1349
Loa Loa (eye worm)	beta-lactamase	0.0035	0.0251	0.0472
Echinococcus multilocularis	protoporphyrinogen oxidase	0.0021	0.0063	0.0063
Schistosoma mansoni	hypothetical protein	0.008	0.0821	0.098
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0396	0.0745
Mycobacterium ulcerans	monoamine oxidase	0.0021	0.0063	0.0058
Brugia malayi	AMP-binding enzyme family protein	0.0047	0.0396	0.0745
Mycobacterium ulcerans	acyl-CoA synthetase	0.0047	0.0396	0.1022
Schistosoma mansoni	ap endonuclease	0.0023	0.009	0.0108
Loa Loa (eye worm)	runx1	0.0055	0.0494	0.093
Schistosoma mansoni	terminal deoxycytidyl transferase	0.0019	0.0043	0.0051
Echinococcus granulosus	survival motor neuron protein 1	0.0286	0.3418	0.4076
Mycobacterium ulcerans	long-chain fatty-acid CoA ligase	0.0047	0.0396	0.1022
Trypanosoma cruzi	UDP-galactopyranose mutase	0.0021	0.0063	0.0519
Echinococcus multilocularis	terminal deoxycytidyl transferase rev1	0.0019	0.0043	0.0043
Brugia malayi	jmjC domain containing protein	0.0058	0.0542	0.1021
Loa Loa (eye worm)	MH2 domain-containing protein	0.0117	0.1288	0.2424
Trichomonas vaginalis	CAMK family protein kinase	0.0094	0.0996	0.1349
Leishmania major	calpain-like cysteine peptidase, putative,cysteine peptidase, Clan CA, family C2, putative	0.0111	0.121	1
Mycobacterium ulcerans	oxidoreductase	0.0021	0.0063	0.0058
Mycobacterium tuberculosis	Conserved protein	0.0035	0.0251	0.0624
Trichomonas vaginalis	penicillin-binding protein, putative	0.0035	0.0251	0.0294
Echinococcus multilocularis	Transcription factor, JmjC domain containing protein	0.0058	0.0542	0.0542
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0577	0.7113	1
Mycobacterium ulcerans	dehydrogenase	0.0021	0.0063	0.0058
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0043	0.0081
Mycobacterium leprae	Probable fructose bisphosphate aldolase Fba	0.0282	0.3374	1
Trypanosoma brucei	hypothetical protein, conserved	0.0035	0.0251	0.2071
Mycobacterium ulcerans	long-chain-fatty-acid-CoA ligase	0.0047	0.0396	0.1022
Brugia malayi	AMP-binding enzyme family protein	0.0047	0.0396	0.0745
Trypanosoma cruzi	hypothetical protein, conserved	0.0035	0.0251	0.2071
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0577	0.7113	1
Plasmodium vivax	hypothetical protein, conserved	0.0021	0.0063	0.2509
Loa Loa (eye worm)	hypothetical protein	0.0102	0.1097	0.2066
Brugia malayi	ImpB/MucB/SamB family protein	0.0019	0.0043	0.0081
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0047	0.0396	0.1005
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0031	0.0197	0.0371
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0031	0.0197	0.0371
Echinococcus granulosus	sterol regulatory element binding protein	0.0083	0.086	0.1025
Schistosoma mansoni	patched 1	0.0083	0.086	0.1025
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0063	0.0118
Schistosoma mansoni	hypothetical protein	0.0031	0.0197	0.0235
Echinococcus multilocularis	lysine specific histone demethylase 1A	0.0021	0.0063	0.0063
Echinococcus granulosus	tumor susceptibility gene 101 protein	0.0068	0.0668	0.0796
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0251	0.0472
Plasmodium vivax	lysine-specific histone demethylase 1, putative	0.0021	0.0063	0.2509
Echinococcus multilocularis	GPCR, family 2	0.0031	0.0197	0.0197
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0396	0.0745
Mycobacterium leprae	Probable lipase LipE	0.0035	0.0251	0.0567
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.009	0.0947	0.0947
Echinococcus multilocularis	transfer RNA-Lys	0.0044	0.0363	0.0363
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0098	0.105	0.1976
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0047	0.0396	0.1005
Mycobacterium tuberculosis	Possible conserved lipoprotein LpqK	0.0035	0.0251	0.0624
Trypanosoma brucei	unspecified product	0.0019	0.0043	0.0354
Mycobacterium ulcerans	acyl-CoA synthetase	0.0047	0.0396	0.1022
Entamoeba histolytica	tumor susceptibility gene 101 protein, putative	0.0046	0.0391	0.0493
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0047	0.0396	0.1022
Trypanosoma cruzi	Vps23 core domain containing protein, putative	0.0022	0.0079	0.0656
Onchocerca volvulus		0.0035	0.0251	0.0358
Trypanosoma brucei	DNA polymerase IV, putative	0.0019	0.0043	0.0354
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0035	0.0251	0.0299
Leishmania major	hypothetical protein, conserved	0.0022	0.0079	0.0656
Loa Loa (eye worm)	hypothetical protein	0.0083	0.086	0.1618
Schistosoma mansoni	Lysine-specific histone demethylase 1	0.0021	0.0063	0.0075
Trypanosoma brucei	DNA polymerase eta, putative	0.0019	0.0043	0.0354
Trichomonas vaginalis	esterase, putative	0.0035	0.0251	0.0294
Echinococcus granulosus	expressed conserved protein	0.0183	0.2116	0.2523
Loa Loa (eye worm)	hypothetical protein	0.0098	0.105	0.1976
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0063	0.0118
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0098	0.105	0.1976
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0035	0.0251	0.0472
Wolbachia endosymbiont of Brugia malayi	exonuclease III	0.0023	0.009	0.5
Entamoeba histolytica	exodeoxyribonuclease III, putative	0.0023	0.009	0.0067
Brugia malayi	Iron-sulfur cluster assembly accessory protein	0.0058	0.054	0.1017
Echinococcus multilocularis	protein dispatched 1	0.0095	0.1009	0.1009
Plasmodium vivax	acyl-CoA synthetase, putative	0.0035	0.0246	0.9812
Brugia malayi	AMP-binding enzyme family protein	0.0047	0.0396	0.0745
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0033	0.0222	0.0537
Brugia malayi	hypothetical protein	0.0021	0.0063	0.0118
Loa Loa (eye worm)	abnormal chemotaxis protein 14	0.0083	0.086	0.1618
Echinococcus granulosus	aryl hydrocarbon receptor	0.0129	0.1436	0.1713
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0063	0.0118
Trypanosoma brucei	hypothetical protein	0.0111	0.121	1
Trypanosoma brucei	DNA polymerase IV, putative	0.0019	0.0043	0.0354
Trypanosoma cruzi	cysteine peptidase, Clan CA, family C2, putative	0.0111	0.121	1
Echinococcus granulosus	hypothetical protein	0.0027	0.0145	0.0173
Schistosoma mansoni	hypothetical protein	0.008	0.0821	0.098
Schistosoma mansoni	hypothetical protein	0.0027	0.0145	0.0173
Schistosoma mansoni	DNA polymerase eta	0.0019	0.0043	0.0051
Mycobacterium tuberculosis	Probable flavin-containing monoamine oxidase AofH (amine oxidase) (MAO)	0.0271	0.3236	0.9586
Loa Loa (eye worm)	hypothetical protein	0.0129	0.143	0.2692
Treponema pallidum	fructose-bisphosphate aldolase	0.0577	0.7113	1
Loa Loa (eye worm)	hypothetical protein	0.0068	0.0668	0.1257
Loa Loa (eye worm)	tumor suppressor	0.0319	0.3847	0.7242
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0098	0.105	0.1976
Trypanosoma cruzi	polo-like protein kinase, putative	0.0094	0.0996	0.8234
Trypanosoma brucei	variant surface glycoprotein (VSG), putative	0.0111	0.121	1
Schistosoma mansoni	niemann-pick C1 (NPC1)	0.0198	0.2303	0.2747
Mycobacterium ulcerans	lipase LipD	0.0035	0.0251	0.0602
Echinococcus granulosus	Protein patched homolog 1	0.0083	0.086	0.1025
Schistosoma mansoni	amine oxidase	0.0021	0.0063	0.0075

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	0.3162 uM	PubChem BioAssay. qHTS Assay for Inhibitors of the Human Apurinic/apyrimidinic Endonuclease 1 (APE1). (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	= 3.1623 um	PUBCHEM_BIOASSAY: qHTS Assay for Enhancers of SMN2 Splice Variant Expression. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	5.6234 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b: Cytotox Counterscreen. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588855, AID588860]	ChEMBL.	No reference
Potency (functional)	8.2753 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

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Plasmodium falciparum	ChEMBL23
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: CHEMBL1485748

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1344173