TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 313.351 | Formula: C17H19N3O3
H donors: 2 H acceptors: 3 LogP: -0.36 Rotable bonds: 3
Rule of 5 violations (Lipinski): 1
SMILES: NC1CCN(C1)c1ccc2c(c1)n(cc(c2=O)C(=O)O)C1CC1
InChi: 1S/C17H19N3O3/c18-10-5-6-19(8-10)12-3-4-13-15(7-12)20(11-1-2-11)9-14(16(13)21)17(22)23/h3-4,7,9-11H,1-2,5-6,8,18H2,(H,22,23)
InChiKey: JMTRETSMUZMYSV-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

No synonyms found for this compound

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
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0018	0.0018	0.0063
Mycobacterium leprae	conserved hypothetical protein	0.0036	0.0065	0.0194
Leishmania major	cathepsin L-like protease	0.0067	0.0143	0.0434
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0018	0.0018	0.0063
Plasmodium vivax	V-type H(+)-translocating pyrophosphatase, putative	0.036	0.0885	0.3062
Echinococcus multilocularis	prenyl (decaprenyl) diphosphate synthase	0.0355	0.0872	0.0872
Onchocerca volvulus		0.0018	0.0018	0.003
Mycobacterium ulcerans	fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE	0.0036	0.0065	0.0194
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0018	0.0018	0.0063
Echinococcus granulosus	DNA apurinic or apyrimidinic site lyase	0.002	0.0024	0.0024
Loa Loa (eye worm)	hypothetical protein	0.0247	0.0601	0.0661
Loa Loa (eye worm)	hexokinase type II	0.0091	0.0205	0.0226
Schistosoma mansoni	ap endonuclease	0.002	0.0024	0.0055
Treponema pallidum	hexokinase (hxk)	0.0091	0.0205	0.1335
Schistosoma mansoni	hexokinase	0.0091	0.0205	0.0476
Onchocerca volvulus	Hexokinase homolog	0.0057	0.0119	0.0195
Echinococcus multilocularis	cathepsin L cysteine protease	0.0018	0.0018	0.0018
Leishmania major	farnesyl pyrophosphate synthase	0.1152	0.2891	1
Giardia lamblia	Farnesyl diphosphate synthase	0.1152	0.2891	1
Mycobacterium tuberculosis	Probable esterase LipL	0.0036	0.0065	0.0124
Schistosoma mansoni	subfamily M12B unassigned peptidase (M12 family)	0.0171	0.0406	0.0942
Mycobacterium tuberculosis	Probable esterase/lipase LipP	0.0036	0.0065	0.0124
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0018	0.0018	0.0018
Leishmania major	GTP-binding protein, putative	0.0021	0.0027	0.0032
Onchocerca volvulus		0.0091	0.0205	0.0337
Brugia malayi	metalloprotease disintegrin 16 with thrombospondin type I motif	0.0808	0.202	0.3042
Trypanosoma brucei	Pyrophosphate-energized vacuolar membrane proton pump 2, putative	0.036	0.0885	0.3062
Schistosoma mansoni	hypothetical protein	0.0016	0.0014	0.0032
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0012	0.0004	0.0012
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0036	0.0065	0.0098
Plasmodium falciparum	cysteine proteinase falcipain 3	0.0018	0.0018	0.0063
Echinococcus multilocularis	adam	0.0298	0.0727	0.0727
Echinococcus multilocularis	hexokinase type 2	0.0091	0.0205	0.0205
Toxoplasma gondii	V-type H(+)-translocating pyrophosphatase VP1	0.036	0.0885	0.3062
Leishmania major	hypothetical protein, conserved	0.0036	0.0065	0.0162
Mycobacterium ulcerans	geranylgeranyl pyrophosphate synthase	0.1152	0.2891	0.8674
Trypanosoma brucei	hexokinase	0.0091	0.0205	0.071
Brugia malayi	Cathepsin L-like precursor	0.0012	0.0004	0.0005
Loa Loa (eye worm)	GTP-binding nuclear protein RAN/TC4	0.0021	0.0027	0.003
Toxoplasma gondii	polyprenyl synthetase superfamily protein	0.0355	0.0872	0.3015
Brugia malayi	ADAM-TS Spacer 1 family protein	0.0127	0.0295	0.0445
Echinococcus granulosus	decaprenyl diphosphate synthase subunit 1	0.0355	0.0872	0.0872
Echinococcus multilocularis	Blood coagulation inhibitor, Disintegrin	0.1074	0.2693	0.2693
Trypanosoma cruzi	vacuolar-type proton translocating pyrophosphatase 1	0.036	0.0885	0.3062
Echinococcus granulosus	GTP binding nuclear protein Ran	0.0021	0.0027	0.0027
Leishmania major	hexokinase, putative	0.0091	0.0205	0.0651
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0012	0.0004	0.0012
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0036	0.0065	0.0065
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0004	0.0004
Echinococcus multilocularis	GTP binding nuclear protein Ran	0.0021	0.0027	0.0027
Loa Loa (eye worm)	hexokinase	0.0028	0.0045	0.005
Echinococcus granulosus	importin subunit beta 1	0.0029	0.0047	0.0047
Onchocerca volvulus		0.0018	0.0018	0.003
Echinococcus granulosus	prenyl decaprenyl diphosphate synthase	0.0355	0.0872	0.0872
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0067	0.0143	0.0495
Brugia malayi	Matrixin family protein	0.1089	0.2731	0.4113
Schistosoma mansoni	ap endonuclease	0.002	0.0024	0.0055
Mycobacterium tuberculosis	Probable multifunctional geranylgeranyl pyrophosphate synthetase IdsA1 (GGPP synthetase) (ggppsase) (geranylgeranyl diphosphate	0.0355	0.0872	0.2562
Trypanosoma brucei	importin beta-1 subunit, putative	0.0029	0.0047	0.0162
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0018	0.0018	0.0063
Brugia malayi	Cathepsin L-like precursor	0.0018	0.0018	0.0028
Echinococcus granulosus	survival motor neuron protein 1	0.0247	0.0601	0.0601
Echinococcus granulosus	cathepsin l1	0.0018	0.0018	0.0018
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.0018	0.0018	0.002
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0018	0.0018	0.0063
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0018	0.0018	0.0063
Brugia malayi	Latrophilin receptor protein 2	0.0016	0.0014	0.0021
Mycobacterium ulcerans	hydrolase	0.1326	0.3332	1
Plasmodium vivax	geranylgeranyl pyrophosphate synthase	0.1152	0.2891	1
Mycobacterium tuberculosis	Possible polyprenyl synthetase IdsB (polyprenyl transferase) (polyprenyl diphosphate synthase)	0.0355	0.0872	0.2562
Echinococcus multilocularis	decaprenyl diphosphate synthase subunit 1	0.0355	0.0872	0.0872
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0067	0.0143	0.0495
Brugia malayi	ADAMTS-like protease	0.0127	0.0295	0.0445
Trichomonas vaginalis	ran, putative	0.0021	0.0027	0.0095
Treponema pallidum	octaprenyl-diphosphate synthase	0.0617	0.1537	1
Plasmodium vivax	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.002	0.0024	0.0082
Plasmodium falciparum	octaprenyl pyrophosphate synthase	0.0355	0.0872	0.3015
Schistosoma mansoni	hypothetical protein	0.1544	0.3884	0.9017
Leishmania major	vacuolar-type proton translocating pyrophosphatase 1, putative	0.036	0.0885	0.3018
Loa Loa (eye worm)	hexokinase	0.0091	0.0205	0.0226
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0067	0.0143	0.0495
Schistosoma mansoni	cpg binding protein	0.0031	0.0053	0.0123
Loa Loa (eye worm)	hypothetical protein	0.0127	0.0295	0.0325
Mycobacterium ulcerans	beta-lactamase	0.0036	0.0065	0.0194
Toxoplasma gondii	ABC1 family protein	0.0036	0.0065	0.0224
Trichomonas vaginalis	geranylgeranyl pyrophosphate synthase, putative	0.1152	0.2891	1
Echinococcus granulosus	beta LACTamase domain containing family member	0.0036	0.0065	0.0065
Brugia malayi	Hexokinase family protein	0.0091	0.0205	0.0309
Loa Loa (eye worm)	fibroinase	0.0018	0.0018	0.002
Mycobacterium tuberculosis	Probable lipase LipD	0.0036	0.0065	0.0124
Trypanosoma cruzi	hypothetical protein, conserved	0.0036	0.0065	0.0224
Trypanosoma cruzi	cysteine peptidase, putative	0.0067	0.0143	0.0495
Chlamydia trachomatis	geranylgeranyl pyrophosphate synthase	0.0355	0.0872	1
Echinococcus granulosus	cathepsin L cysteine proteinase	0.0018	0.0018	0.0018
Brugia malayi	Cathepsin L-like precursor	0.0018	0.0018	0.0028
Mycobacterium ulcerans	geranylgeranyl pyrophosphate synthase	0.1152	0.2891	0.8674
Echinococcus granulosus	hexokinase type 2	0.0091	0.0205	0.0205
Echinococcus granulosus	hexokinase	0.0091	0.0205	0.0205
Toxoplasma gondii	HEAT repeat-containing protein	0.0029	0.0047	0.0162
Trypanosoma cruzi	Vacuolar proton pyrophosphatase 1, putative	0.036	0.0885	0.3062
Onchocerca volvulus		0.0018	0.0018	0.003
Mycobacterium tuberculosis	Probable geranylgeranyl pyrophosphate synthetase IdsA2 (ggppsase) (GGPP synthetase) (geranylgeranyl diphosphate synthase)	0.1152	0.2891	0.8665
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0018	0.0018	0.0063
Toxoplasma gondii	hexokinase	0.0091	0.0205	0.071
Loa Loa (eye worm)	hypothetical protein	0.0171	0.0406	0.0447
Brugia malayi	RNA, U transporter 1	0.0082	0.0181	0.0272
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0018	0.0018	0.002
Trichomonas vaginalis	ap endonuclease, putative	0.002	0.0024	0.0082
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0018	0.0018	0.0063
Brugia malayi	Matrix metalloprotease, N-terminal domain containing protein	0.1326	0.3332	0.5018
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0065	0.0071
Loa Loa (eye worm)	beta-lactamase	0.0036	0.0065	0.0071
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0048	0.0095	0.0221
Brugia malayi	Papain family cysteine protease containing protein	0.0018	0.0018	0.0028
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0016	0.0014	0.0015
Schistosoma mansoni	cathepsin F (C01 family)	0.0012	0.0004	0.0008
Echinococcus granulosus	adam	0.0298	0.0727	0.0727
Echinococcus multilocularis	DNA (apurinic or apyrimidinic site) lyase	0.002	0.0024	0.0024
Trypanosoma cruzi	solanesyl-diphosphate synthase, putative	0.0355	0.0872	0.3015
Mycobacterium tuberculosis	Probable peptidoglycan hydrolase	0.1326	0.3332	1
Echinococcus granulosus	cathepsin l cysteine peptidase	0.0018	0.0018	0.0018
Onchocerca volvulus		0.0018	0.0018	0.003
Brugia malayi	beta-lactamase family protein	0.0036	0.0065	0.0098
Trypanosoma cruzi	cysteine peptidase, putative	0.0067	0.0143	0.0495
Brugia malayi	beta-lactamase	0.0036	0.0065	0.0098
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0065	0.0071
Entamoeba histolytica	hypothetical protein	0.0023	0.0033	0.0378
Onchocerca volvulus		0.1089	0.2731	0.4485
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0065	0.0071
Toxoplasma gondii	cathepsin CPL	0.0018	0.0018	0.0063
Schistosoma mansoni	hypothetical protein	0.005	0.0102	0.0236
Trypanosoma cruzi	GTP-binding nuclear protein rtb2, putative	0.0021	0.0027	0.0095
Mycobacterium ulcerans	lipase LipD	0.0036	0.0065	0.0194
Schistosoma mansoni	adam (A disintegrin and metalloprotease	0.0298	0.0727	0.1688
Echinococcus multilocularis	geranylgeranyl pyrophosphate synthase	0.0617	0.1537	0.1537
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0018	0.0018	0.0063
Mycobacterium ulcerans	polyprenyl synthetase IdsB	0.0355	0.0872	0.2615
Loa Loa (eye worm)	hypothetical protein	0.3597	0.908	1
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	0.002	0.0024	0.0026
Brugia malayi	cathepsin L-like precursor	0.0012	0.0004	0.0005
Schistosoma mansoni	survival motor neuron protein	0.005	0.0102	0.0236
Echinococcus multilocularis	importin subunit beta 1	0.0029	0.0047	0.0047
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0048	0.0095	0.0221
Loa Loa (eye worm)	hypothetical protein	0.0018	0.0018	0.002
Echinococcus granulosus	disintegrin and metalloproteinase	0.0171	0.0406	0.0406
Echinococcus multilocularis	GPCR, family 2	0.0016	0.0014	0.0014
Loa Loa (eye worm)	hypothetical protein	0.0034	0.006	0.0066
Loa Loa (eye worm)	hypothetical protein	0.0127	0.0295	0.0325
Schistosoma mansoni	matrix metallopeptidase-9 (M10 family)	0.0783	0.1957	0.4544
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0016	0.0014	0.0021
Onchocerca volvulus		0.0036	0.0065	0.0106
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0048	0.0095	0.0143
Mycobacterium leprae	PROBABLE POLYPRENYL-DIPHOSPHATE SYNTHASE GRCC1 (POLYPRENYL PYROPHOSPHATE SYNTHETASE)	0.0355	0.0872	0.2615
Leishmania major	cathepsin L-like protease	0.0067	0.0143	0.0434
Brugia malayi	CXXC zinc finger family protein	0.0031	0.0053	0.008
Schistosoma mansoni	hypothetical protein	0.0446	0.1103	0.256
Schistosoma mansoni	cpg binding protein	0.0033	0.0058	0.0134
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0036	0.0065	0.0071
Trichomonas vaginalis	D-aminoacylase, putative	0.0036	0.0065	0.0224
Loa Loa (eye worm)	nucleolar RNA-associated protein alpha	0.0307	0.0751	0.0827
Mycobacterium leprae	PROBABLE HYDROLASE	0.1326	0.3332	1
Loa Loa (eye worm)	ctsf protein	0.0018	0.0018	0.002
Treponema pallidum	exodeoxyribonuclease (exoA)	0.002	0.0024	0.0155
Entamoeba histolytica	hexokinase 1	0.0091	0.0205	0.2355
Trypanosoma cruzi	solanesyl-diphosphate synthase, putative	0.0355	0.0872	0.3015
Plasmodium falciparum	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.002	0.0024	0.0082
Trichomonas vaginalis	ap endonuclease, putative	0.002	0.0024	0.0082
Entamoeba histolytica	hexokinase 2	0.0091	0.0205	0.2355
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.005	0.01	0.015
Echinococcus granulosus	Blood coagulation inhibitor Disintegrin	0.1074	0.2693	0.2693
Onchocerca volvulus		0.0158	0.0374	0.0614
Schistosoma mansoni	geranylgeranyl pyrophosphate synthase	0.0617	0.1537	0.3568
Brugia malayi	Matrixin family protein	0.1089	0.2731	0.4113
Brugia malayi	hypothetical protein	0.0158	0.0374	0.0563
Echinococcus granulosus	subfamily M12B unassigned peptidase	0.0171	0.0406	0.0406
Brugia malayi	hexokinase	0.0091	0.0205	0.0309
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0065	0.0071
Loa Loa (eye worm)	hypothetical protein	0.1089	0.2731	0.3008
Mycobacterium ulcerans	exodeoxyribonuclease III protein XthA	0.002	0.0024	0.0071
Brugia malayi	Polyprenyl synthetase family protein	0.0355	0.0872	0.1312
Trichomonas vaginalis	D-aminoacylase, putative	0.0036	0.0065	0.0224
Echinococcus multilocularis	a disintegrin and metalloproteinase with	0.0808	0.202	0.202
Mycobacterium tuberculosis	Possible conserved lipoprotein LpqK	0.0036	0.0065	0.0124
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0018	0.0018	0.0063
Schistosoma mansoni	hypothetical protein	0.0016	0.0014	0.0032
Plasmodium falciparum	GTP-binding nuclear protein RAN/TC4	0.0021	0.0027	0.0095
Trichomonas vaginalis	geranylgeranyl pyrophosphate synthase, putative	0.1152	0.2891	1
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0059	0.0124	0.0429
Onchocerca volvulus		0.005	0.0102	0.0167
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0016	0.0014	0.0014
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0065	0.0071
Schistosoma mansoni	hypothetical protein	0.0034	0.006	0.0139
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease, putative	0.002	0.0024	0.0082
Loa Loa (eye worm)	matrixin family protein	0.2633	0.6641	0.7314
Entamoeba histolytica	cysteine proteinase, putative	0.0012	0.0004	0.0041
Brugia malayi	Cathepsin L-like precursor	0.0012	0.0004	0.0005
Trichomonas vaginalis	geranylgeranyl diphosphate synthase, putative	0.1152	0.2891	1
Brugia malayi	Cathepsin L-like precursor	0.0018	0.0018	0.0028
Brugia malayi	GTP-binding nuclear protein RAN/TC4	0.0021	0.0027	0.0041
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0031	0.0053	0.0059
Entamoeba histolytica	cysteine protease, putative	0.0018	0.0018	0.021
Wolbachia endosymbiont of Brugia malayi	geranylgeranyl pyrophosphate synthase	0.0355	0.0872	1
Echinococcus granulosus	hexokinase	0.0091	0.0205	0.0205
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0018	0.0018	0.0063
Giardia lamblia	Endonuclease/Exonuclease/phosphatase	0.002	0.0024	0.0082
Loa Loa (eye worm)	reprolysin	0.0171	0.0406	0.0447
Trypanosoma brucei	Pyrophosphate-energized vacuolar membrane proton pump 1	0.036	0.0885	0.3062
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.005	0.01	0.011
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0036	0.0065	0.015
Echinococcus multilocularis	adam 17 protease	0.1712	0.4307	0.4307
Brugia malayi	Cathepsin L-like precursor	0.0018	0.0018	0.0028
Leishmania major	importin beta-1 subunit, putative	0.0023	0.0033	0.0051
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.0018	0.0018	0.0063
Schistosoma mansoni	subfamily M12B unassigned peptidase (M12 family)	0.0171	0.0406	0.0942
Loa Loa (eye worm)	hypothetical protein	0.1089	0.2731	0.3008
Echinococcus granulosus	a disintegrin and metalloproteinase with	0.0808	0.202	0.202
Trypanosoma cruzi	cysteine peptidase, putative	0.0018	0.0018	0.0063
Trypanosoma brucei	solanesyl-diphosphate synthase, putative	0.0355	0.0872	0.3015
Wolbachia endosymbiont of Brugia malayi	geranylgeranyl pyrophosphate synthase	0.0355	0.0872	1
Entamoeba histolytica	geranylgeranyl pyrophosphate synthetase, putative	0.0355	0.0872	1
Plasmodium vivax	vivapain-2	0.0018	0.0018	0.0063
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0018	0.0018	0.0063
Trypanosoma cruzi	farnesyl pyrophosphate synthase	0.1152	0.2891	1
Plasmodium falciparum	geranylgeranyl pyrophosphate synthase, putative	0.1152	0.2891	1
Onchocerca volvulus		0.0036	0.0065	0.0106
Loa Loa (eye worm)	polyprenyl synthetase	0.0355	0.0872	0.096
Echinococcus multilocularis	hexokinase	0.0091	0.0205	0.0205
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0018	0.0018	0.0063
Echinococcus multilocularis	hexokinase	0.0091	0.0205	0.0205
Echinococcus granulosus	GPCR family 2	0.0016	0.0014	0.0014
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0018	0.0018	0.0063
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0048	0.0095	0.0221
Plasmodium vivax	vivapain-2	0.0018	0.0018	0.0063
Loa Loa (eye worm)	matrixin family protein	0.2416	0.609	0.6707
Toxoplasma gondii	GTP-binding nuclear protein ran/tc4	0.0021	0.0027	0.0095
Trypanosoma brucei	apurinic/apyrimidinic endonuclease, putative	0.002	0.0024	0.0082
Onchocerca volvulus	Matrix metalloproteinase homolog	0.2416	0.609	1
Leishmania major	apurinic/apyrimidinic endonuclease-redox protein	0.002	0.0024	0.0019
Schistosoma mansoni	cathepsin F (C01 family)	0.0018	0.0018	0.0042
Brugia malayi	Hexokinase family protein	0.0028	0.0045	0.0068
Schistosoma mansoni	trans-prenyltransferase	0.0355	0.0872	0.2023
Mycobacterium ulcerans	esterase/lipase LipP	0.0036	0.0065	0.0194
Echinococcus granulosus	adam 17 protease	0.1882	0.4739	0.4739
Echinococcus multilocularis	farnesyl pyrophosphate synthase	0.1152	0.2891	0.2891
Schistosoma mansoni	ran	0.0021	0.0027	0.0064
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0016	0.0014	0.0014
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0229	0.0555	0.1604
Brugia malayi	Matrixin family protein	0.1089	0.2731	0.4113
Toxoplasma gondii	exonuclease III APE	0.002	0.0024	0.0082
Trypanosoma cruzi	hexokinase, putative	0.0091	0.0205	0.071
Onchocerca volvulus		0.0018	0.0018	0.003
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0047	0.0052
Schistosoma mansoni	dihydroceramide desaturase	0.0171	0.0406	0.0942
Mycobacterium ulcerans	hypothetical protein	0.0036	0.0065	0.0194
Entamoeba histolytica	cysteine proteinase, putative	0.0018	0.0018	0.021
Leishmania major	solanesyl-diphosphate synthase, putative	0.0355	0.0872	0.2971
Onchocerca volvulus		0.0031	0.0053	0.0087
Schistosoma mansoni	glutathione synthetase	0.0355	0.0872	0.2023
Onchocerca volvulus		0.0091	0.0205	0.0337
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0018	0.0018	0.0063
Plasmodium vivax	vacuolar-type H+ pumping pyrophosphatase, putative	0.036	0.0885	0.3062
Loa Loa (eye worm)	hypothetical protein	0.0127	0.0295	0.0325
Echinococcus multilocularis	matrix metallopeptidase 7 (M10 family)	0.396	1	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0067	0.0143	0.0495
Echinococcus granulosus	farnesyl pyrophosphate synthase	0.1152	0.2891	0.2891
Onchocerca volvulus	Matrilysin homolog	0.2416	0.609	1
Brugia malayi	Cathepsin L-like precursor	0.0018	0.0018	0.0028
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0067	0.0143	0.0495
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0067	0.0143	0.0495
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0004	0.0004
Entamoeba histolytica	Ran family GTPase	0.0021	0.0027	0.0315
Loa Loa (eye worm)	cysteine protease	0.0018	0.0018	0.002
Onchocerca volvulus		0.0057	0.0119	0.0195
Echinococcus multilocularis	cathepsin L cysteine protease	0.0018	0.0018	0.0018
Trypanosoma cruzi	polyprenyl synthase, putative	0.0617	0.1537	0.5316
Onchocerca volvulus		0.0012	0.0004	0.0006
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0047	0.0052
Trypanosoma cruzi	importin beta-1 subunit, putative	0.0023	0.0033	0.0114
Loa Loa (eye worm)	hypothetical protein	0.0062	0.0132	0.0145
Schistosoma mansoni	ADAMTS5 peptidase (M12 family)	0.0808	0.202	0.469
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease	0.002	0.0024	0.0082
Brugia malayi	angiogenesis inhibito	0.0127	0.0295	0.0445
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0048	0.0095	0.0095
Plasmodium vivax	hexokinase, putative	0.0091	0.0205	0.071
Echinococcus multilocularis	cysteine protease	0.0018	0.0018	0.0018
Schistosoma mansoni	cathepsin F (C01 family)	0.0018	0.0018	0.0042
Schistosoma mansoni	hypothetical protein	0.0016	0.0014	0.0032
Mycobacterium tuberculosis	Conserved protein	0.0036	0.0065	0.0124
Giardia lamblia	GTP-binding nuclear protein RAN/TC4	0.0021	0.0027	0.0095
Trypanosoma cruzi	cruzipain precursor, putative	0.0067	0.0143	0.0495
Loa Loa (eye worm)	hypothetical protein	0.005	0.01	0.011
Echinococcus multilocularis	subfamily M12B unassigned peptidase	0.0171	0.0406	0.0406
Entamoeba histolytica	cysteine proteinase, putative	0.0018	0.0018	0.021
Brugia malayi	Polyprenyl synthetase family protein	0.1152	0.2891	0.4352
Echinococcus granulosus	hexokinase	0.0091	0.0205	0.0205
Plasmodium vivax	hypothetical protein, conserved	0.0036	0.0065	0.0224
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.0018	0.0018	0.0063
Onchocerca volvulus	Cathepsin L homolog	0.0018	0.0018	0.003
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0018	0.0018	0.0063
Echinococcus multilocularis	cysteine protease	0.0018	0.0018	0.0018
Mycobacterium tuberculosis	Probable conserved lipoprotein	0.0036	0.0065	0.0124
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0067	0.0143	0.0495
Onchocerca volvulus	Cathepsin L homolog	0.0018	0.0018	0.003
Echinococcus multilocularis	hexokinase	0.0091	0.0205	0.0205
Echinococcus multilocularis	snurportin 1	0.0307	0.0751	0.0751
Trichomonas vaginalis	Importin beta-1 subunit, putative	0.0023	0.0033	0.0114
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0036	0.0065	0.015
Brugia malayi	Importin beta-1 subunit	0.0029	0.0047	0.007
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0066	0.0142	0.033
Trypanosoma cruzi	hexokinase, putative	0.0091	0.0205	0.071
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0048	0.0095	0.0095
Loa Loa (eye worm)	polyprenyl synthetase	0.1152	0.2891	0.3183
Brugia malayi	Cathepsin L-like cysteine proteinase	0.0012	0.0004	0.0005
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0018	0.0018	0.0063
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0018	0.0018	0.0063
Entamoeba histolytica	geranylgeranyl pyrophosphate synthase, putative	0.0355	0.0872	1
Loa Loa (eye worm)	hypothetical protein	0.0012	0.0004	0.0004
Schistosoma mansoni	importin beta-1	0.0029	0.0047	0.0108
Schistosoma mansoni	ADAM17 peptidase (M12 family)	0.1712	0.4307	1
Trypanosoma cruzi	solanesyl-diphosphate synthase	0.0355	0.0872	0.3015
Onchocerca volvulus	Cathepsin F homolog	0.0018	0.0018	0.003
Toxoplasma gondii	polyprenyl synthetase superfamily protein	0.1152	0.2891	1
Echinococcus granulosus	snurportin 1	0.0307	0.0751	0.0751
Wolbachia endosymbiont of Brugia malayi	exonuclease III	0.002	0.0024	0.0272
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0048	0.0095	0.0105
Loa Loa (eye worm)	hypothetical protein	0.1089	0.2731	0.3008
Onchocerca volvulus		0.0018	0.0018	0.003
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0018	0.0018	0.0063
Entamoeba histolytica	exodeoxyribonuclease III, putative	0.002	0.0024	0.0272
Plasmodium vivax	octaprenyl pyrophosphate synthase, putative	0.0355	0.0872	0.3015
Plasmodium falciparum	importin beta, putative	0.0029	0.0047	0.0162
Trichomonas vaginalis	esterase, putative	0.0036	0.0065	0.0224
Onchocerca volvulus		0.0036	0.0065	0.0106
Trypanosoma brucei	farnesyl pyrophosphate synthase	0.1152	0.2891	1
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0016	0.0014	0.0014
Trypanosoma cruzi	GTP-binding nuclear protein rtb2, putative	0.0021	0.0027	0.0095
Brugia malayi	Hemopexin family protein	0.1544	0.3884	0.5848
Leishmania major	hexokinase, putative	0.0091	0.0205	0.0651
Loa Loa (eye worm)	matrix metalloproteinase	0.1089	0.2731	0.3008
Brugia malayi	latrophilin 2 splice variant baaae	0.0034	0.006	0.009
Schistosoma mansoni	hypothetical protein	0.0307	0.0751	0.1743
Echinococcus multilocularis	disintegrin and metalloproteinase	0.0171	0.0406	0.0406
Mycobacterium tuberculosis	Probable polyprenyl-diphosphate synthase GrcC2 (polyprenyl pyrophosphate synthetase)	0.0355	0.0872	0.2562
Trypanosoma brucei	hexokinase, putative	0.0091	0.0205	0.071
Brugia malayi	hypothetical protein	0.0247	0.0601	0.0904
Onchocerca volvulus		0.1544	0.3884	0.6377
Trichomonas vaginalis	Importin beta-1 subunit, putative	0.0023	0.0033	0.0114
Leishmania major	polyprenyl synthase, putative	0.0617	0.1537	0.5286
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0067	0.0143	0.0495
Trichomonas vaginalis	penicillin-binding protein, putative	0.0036	0.0065	0.0224
Plasmodium vivax	GTP-binding nuclear protein RAN/TC4, putative	0.0021	0.0027	0.0095
Trypanosoma cruzi	hypothetical protein, conserved	0.0036	0.0065	0.0224
Schistosoma mansoni	hypothetical protein	0.0016	0.0014	0.0032
Brugia malayi	hypothetical protein	0.0298	0.0727	0.1095
Mycobacterium tuberculosis	Conserved protein	0.0036	0.0065	0.0124
Brugia malayi	Calcitonin receptor-like protein seb-1	0.005	0.01	0.015
Brugia malayi	exodeoxyribonuclease III family protein	0.002	0.0024	0.0036
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0047	0.0051
Loa Loa (eye worm)	hypothetical protein	0.0158	0.0374	0.0412
Brugia malayi	hexokinase type II	0.0029	0.0047	0.0071
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0018	0.0018	0.0018
Mycobacterium tuberculosis	Probable lipase LipE	0.0036	0.0065	0.0124
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0067	0.0143	0.0495
Brugia malayi	beta-lactamase family protein	0.0036	0.0065	0.0098
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0014	0.0015
Echinococcus multilocularis	dnaJ subfamily B	0.0446	0.1103	0.1103
Brugia malayi	Hexokinase family protein	0.0057	0.0119	0.0179
Echinococcus multilocularis	survival motor neuron protein 1	0.0247	0.0601	0.0601
Trypanosoma cruzi	farnesyl pyrophosphate synthase, putative	0.1152	0.2891	1
Brugia malayi	Disintegrin family protein	0.0171	0.0406	0.0611
Plasmodium falciparum	hexokinase	0.0091	0.0205	0.071
Brugia malayi	Cathepsin L-like precursor	0.0018	0.0018	0.0028
Echinococcus granulosus	cathepsin l1	0.0012	0.0004	0.0004
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0067	0.0143	0.0495
Mycobacterium tuberculosis	Conserved protein	0.0036	0.0065	0.0124
Plasmodium falciparum	V-type K+-independent H+-translocating inorganic pyrophosphatase	0.036	0.0885	0.3062
Trichomonas vaginalis	penicillin-binding protein, putative	0.0036	0.0065	0.0224
Brugia malayi	geranylgeranyl pyrophosphate synthetase	0.0617	0.1537	0.2314
Echinococcus granulosus	geranylgeranyl pyrophosphate synthase	0.0617	0.1537	0.1537
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0018	0.0018	0.0063
Trypanosoma brucei	GTP-binding nuclear protein rtb2, putative	0.0021	0.0027	0.0095
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0018	0.0018	0.0063
Echinococcus granulosus	cpg binding protein	0.0033	0.0058	0.0058
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0016	0.0014	0.0014
Trypanosoma cruzi	cysteine peptidase, putative	0.0067	0.0143	0.0495
Onchocerca volvulus		0.0091	0.0205	0.0337
Mycobacterium tuberculosis	Probable hydrolase	0.0036	0.0065	0.0124
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0065	0.0071
Leishmania major	cathepsin L-like protease	0.0067	0.0143	0.0434
Loa Loa (eye worm)	hexokinase	0.0091	0.0205	0.0226
Brugia malayi	Matrixin family protein	0.2633	0.6641	1
Loa Loa (eye worm)	hexokinase	0.0057	0.0119	0.0131
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0018	0.0018	0.0063
Brugia malayi	Matrixin family protein	0.1089	0.2731	0.4113
Entamoeba histolytica	bifunctional short chain isoprenyl diphosphate synthase, putative	0.0355	0.0872	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0018	0.0018	0.0063
Echinococcus multilocularis	cpg binding protein	0.0033	0.0058	0.0058
Schistosoma mansoni	cpg binding protein	0.0033	0.0058	0.0134
Plasmodium vivax	importin-beta 2, putative	0.0029	0.0047	0.0162
Schistosoma mansoni	ran	0.0021	0.0027	0.0064
Schistosoma mansoni	matrix metallopeptidase-7 (M10 family)	0.1089	0.2731	0.6341
Trichomonas vaginalis	D-aminoacylase, putative	0.0036	0.0065	0.0224
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.0061	0.0128	0.0444
Loa Loa (eye worm)	hypothetical protein	0.1326	0.3332	0.367
Schistosoma mansoni	farnesyl pyrophosphate synthase	0.1152	0.2891	0.6711
Loa Loa (eye worm)	geranylgeranyl pyrophosphate synthetase	0.0617	0.1537	0.1692
Onchocerca volvulus	Matrilysin homolog	0.1089	0.2731	0.4485
Mycobacterium leprae	Probable lipase LipE	0.0036	0.0065	0.0194
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0018	0.0018	0.0063
Trichomonas vaginalis	importin beta-1, putative	0.0023	0.0033	0.0114
Plasmodium falciparum	V-type H(+)-translocating pyrophosphatase, putative	0.036	0.0885	0.3062
Mycobacterium ulcerans	polyprenyl diphosphate synthetase, GrcC1	0.0355	0.0872	0.2615
Brugia malayi	Iron-sulfur cluster assembly accessory protein	0.005	0.0102	0.0153
Trypanosoma brucei	hexokinase	0.0091	0.0205	0.071
Trypanosoma brucei	hypothetical protein, conserved	0.0036	0.0065	0.0224
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0048	0.0095	0.0095
Echinococcus granulosus	dnaJ subfamily B	0.0446	0.1103	0.1103
Trypanosoma brucei	importin beta-1 subunit, putative	0.0029	0.0047	0.0162
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0018	0.0018	0.0063
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0048	0.0095	0.0095
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0067	0.0143	0.0495
Trypanosoma cruzi	major cysteine proteinase, putative	0.0052	0.0107	0.0369
Onchocerca volvulus		0.0018	0.0018	0.003
Trypanosoma cruzi	polyprenyl synthase, putative	0.0617	0.1537	0.5316

Activities

Activity type	Activity value	Assay description	Source	Reference
log(1/C) (functional)	= 3.122343	Antimycobacterial activity against Mycobacterium tuberculosis	ChEMBL.	No reference
MIC (functional)	= 0.008 ug ml-1	In vitro antimicrobial activity against strain E. coli 15119	ChEMBL.	1732530
MIC (functional)	= 0.008 ug ml-1	In vitro antimicrobial activity against strain E. coli 15119	ChEMBL.	1732530
MIC (functional)	= 0.06 ug ml-1	In vitro antimicrobial activity against strain K. pneumoniae 9664	ChEMBL.	1732530
MIC (functional)	= 0.13 ug ml-1	In vitro antimicrobial activity against strain E. cloacae 9656	ChEMBL.	1732530
MIC (functional)	= 0.13 ug ml-1	In vitro antimicrobial activity against strain P. mirabilis 9900	ChEMBL.	1732530
MIC (functional)	= 0.13 ug ml-1	In vitro antimicrobial activity against strain M. morganii 15153	ChEMBL.	1732530
MIC (functional)	= 0.25 ug ml-1	In vitro antimicrobial activity against strain S. aureus 9537	ChEMBL.	1732530
MIC (functional)	= 0.5 ug ml-1	In vitro antimicrobial activity against strain P. aeruginosa 9843	ChEMBL.	1732530
MIC (functional)	= 2 ug ml-1	In vitro antimicrobial activity against strain S. pneumoniae 9585	ChEMBL.	1732530
MIC (functional)	= 4 ug ml-1	In vitro antimicrobial activity against strain E. faecalis 9809	ChEMBL.	1732530
MIC (functional)	= 0.000754 uM/ml	Antimycobacterial activity against Mycobacterium tuberculosis	ChEMBL.	No reference

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

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: CHEMBL60426

Bibliographic References

1 literature reference was collected for this gene.

If you have references for this compound, please enter them in a user comment (below) or Contact us.

Detailed information for compound 91714