TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 462.213 | Formula: C13H16BrN7O7
H donors: 5 H acceptors: 7 LogP: 0.72 Rotable bonds: 13
Rule of 5 violations (Lipinski): 1
SMILES: ONC(=O)[C@@H](NC(=O)c1ccc(c(c1)[N+](=O)[O-])Br)CCCNC(=N)N[N+](=O)[O-]
InChi: 1S/C13H16BrN7O7/c14-8-4-3-7(6-10(8)20(25)26)11(22)17-9(12(23)19-24)2-1-5-16-13(15)18-21(27)28/h3-4,6,9,24H,1-2,5H2,(H,17,22)(H,19,23)(H3,15,16,18)/t9-/m0/s1
InChiKey: IJFGERLKSYMSLO-VIFPVBQESA-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

Species	Target name	Source	Bibliographic reference
Sus scrofa	Aminopeptidase N	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Schistosoma japonicum	ko:K01256 membrane alanyl aminopeptidase [EC3.4.11.2], putative	Get druggable targets OG5_127217	All targets in OG5_127217
Echinococcus granulosus	aminopeptidase N	Get druggable targets OG5_127217	All targets in OG5_127217
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_127217	All targets in OG5_127217
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_127217	All targets in OG5_127217
Loa Loa (eye worm)	peptidase family M1 containing protein	Get druggable targets OG5_127217	All targets in OG5_127217
Onchocerca volvulus		Get druggable targets OG5_127217	All targets in OG5_127217
Brugia malayi	Peptidase family M1 containing protein	Get druggable targets OG5_127217	All targets in OG5_127217
Echinococcus multilocularis	aminopeptidase N	Get druggable targets OG5_127217	All targets in OG5_127217

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Echinococcus multilocularis	puromycin sensitive aminopeptidase	Aminopeptidase N	963 aa	981 aa	28.8 %
Echinococcus multilocularis	puromycin sensitive aminopeptidase	Aminopeptidase N	963 aa	988 aa	28.5 %
Echinococcus granulosus	puromycin sensitive aminopeptidase	Aminopeptidase N	963 aa	975 aa	29.1 %
Onchocerca volvulus		Aminopeptidase N	963 aa	893 aa	32.0 %
Echinococcus multilocularis	puromycin sensitive aminopeptidase	Aminopeptidase N	963 aa	981 aa	29.2 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Echinococcus granulosus	carbonic anhydrase	0.0272	0.21	0.3589
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0156	0.0267
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0017	0.002	0.0015
Schistosoma mansoni	microtubule-associated protein tau	0.07	0.56	0.7564
Schistosoma mansoni	carbonic anhydrase II (carbonate dehydratase II)	0.0731	0.5852	0.7905
Schistosoma mansoni	hypothetical protein	0.0032	0.0143	0.0186
Schistosoma mansoni	vesicular amine transporter	0.0021	0.0056	0.0069
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0017	0.002	0.0015
Leishmania major	carbonic anhydrase-like protein	0.0731	0.5852	0.7905
Loa Loa (eye worm)	plexin A	0.0046	0.0262	0.0448
Trypanosoma cruzi	cysteine peptidase, putative	0.0017	0.002	0.0025
Schistosoma mansoni	carbonic anhydrase-related	0.0272	0.21	0.2832
Onchocerca volvulus		0.0017	0.002	0.0058
Schistosoma mansoni	smad1 5 8 and	0.0025	0.0085	0.0108
Brugia malayi	MH1 domain containing protein	0.0025	0.0085	0.0136
Echinococcus granulosus	defective proboscis extension response	0.0021	0.0056	0.0096
Brugia malayi	MH2 domain containing protein	0.0361	0.2827	0.4826
Schistosoma mansoni	plexin	0.0023	0.007	0.0088
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0017	0.002	0.0034
Echinococcus multilocularis	netrin receptor unc 5	0.0021	0.0055	0.0094
Schistosoma mansoni	family M1 non-peptidase homologue (M01 family)	0.0027	0.0107	0.0138
Trypanosoma brucei	Aminopeptidase M1, putative	0.0042	0.0228	0.0381
Echinococcus multilocularis	hypothetical protein	0.0016	0.0018	0.003
Schistosoma mansoni	Smad4	0.0025	0.0085	0.0108
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.0017	0.002	0.0034
Echinococcus granulosus	leukotriene A 4 hydrolase	0.0015	0.0005	0.0009
Echinococcus multilocularis	cysteine protease	0.0017	0.002	0.0034
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0.002	0.0015
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0.002	0.0015
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0018	0.003
Echinococcus multilocularis	puromycin sensitive aminopeptidase	0.0042	0.0228	0.039
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0056	0.0096
Trypanosoma cruzi	aminopeptidase, putative	0.0042	0.0228	0.0381
Loa Loa (eye worm)	hypothetical protein	0.01	0.0701	0.1198
Trypanosoma cruzi	major cysteine proteinase, putative	0.005	0.029	0.0487
Leishmania major	cathepsin L-like protease	0.0017	0.002	0.002
Loa Loa (eye worm)	peptidase family M1 containing protein	0.0116	0.083	0.1418
Loa Loa (eye worm)	MH1 domain-containing protein	0.0025	0.0085	0.0145
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0063	0.0401	0.0677
Trypanosoma cruzi	metallo-peptidase, clan MA(E), family M1, putative	0.0042	0.0228	0.0381
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0063	0.0401	0.0677
Schistosoma mansoni	cytosol alanyl aminopeptidase (M01 family)	0.0042	0.0228	0.0301
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0017	0.002	0.0015
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0063	0.0401	0.0677
Schistosoma mansoni	hypothetical protein	0.0016	0.0018	0.0017
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0056	0.0096
Schistosoma mansoni	tyrosine kinase	0.0016	0.0016	0.0014
Loa Loa (eye worm)	hypothetical protein	0.0272	0.21	0.3589
Echinococcus multilocularis	Immunoglobulin	0.0021	0.0056	0.0096
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0017	0.002	0.0015
Echinococcus multilocularis	roundabout 2	0.0033	0.0156	0.0267
Loa Loa (eye worm)	hypothetical protein	0.0068	0.0443	0.0756
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0063	0.0401	0.0677
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0017	0.002	0.0015
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0.002	0.0015
Loa Loa (eye worm)	aminopeptidase N	0.0042	0.0228	0.039
Echinococcus granulosus	neuroglian	0.0026	0.01	0.0171
Brugia malayi	Sema domain containing protein	0.0016	0.0018	0.0021
Mycobacterium ulcerans	aminopeptidase N PepN	0.0042	0.0228	0.0223
Schistosoma mansoni	nephrin	0.0026	0.01	0.0128
Onchocerca volvulus		0.0016	0.0018	0.005
Schistosoma mansoni	semaphorin 5-related	0.0016	0.0018	0.0017
Echinococcus multilocularis	Smad4	0.0025	0.0085	0.0145
Schistosoma mansoni	hypothetical protein	0.0032	0.0143	0.0186
Onchocerca volvulus		0.0039	0.0203	0.0792
Onchocerca volvulus	Cathepsin F homolog	0.0017	0.002	0.0058
Echinococcus multilocularis	nuclear factor of activated T cells 5	0.0072	0.0472	0.0806
Loa Loa (eye worm)	transcription factor SMAD2	0.0361	0.2827	0.4831
Brugia malayi	latrophilin 2 splice variant baaae	0.0068	0.0443	0.0748
Echinococcus granulosus	carbonic anhydrase	0.0272	0.21	0.3589
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0.002	0.0015
Brugia malayi	hypothetical protein	0.0016	0.0018	0.0021
Onchocerca volvulus		0.0017	0.002	0.0058
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0.002	0.0015
Mycobacterium tuberculosis	Beta-carbonic anhydrase CanB	0.0632	0.5043	0.5187
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0.002	0.0015
Echinococcus multilocularis	neuroglian	0.0026	0.01	0.0171
Mycobacterium tuberculosis	Beta-carbonic anhydrase	0.0951	0.7642	1
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0032	0.0143	0.0244
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0063	0.0401	0.0677
Brugia malayi	Fibronectin type III domain containing protein	0.0021	0.0056	0.0087
Brugia malayi	MH2 domain containing protein	0.0025	0.0085	0.0136
Brugia malayi	Latrophilin receptor protein 2	0.0032	0.0143	0.0235
Echinococcus granulosus	puromycin sensitive aminopeptidase	0.0042	0.0228	0.039
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0017	0.002	0.0015
Echinococcus granulosus	puromycin sensitive aminopeptidase	0.0042	0.0228	0.039
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0017	0.002	0.0015
Echinococcus multilocularis	carbonic anhydrase	0.0272	0.21	0.3589
Echinococcus multilocularis	basement membrane specific heparan sulfate	0.0021	0.0056	0.0096
Onchocerca volvulus	Netrin receptor homolog	0.0019	0.0043	0.015
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0107	0.0183
Loa Loa (eye worm)	ctsf protein	0.0017	0.002	0.0034
Onchocerca volvulus	Cathepsin L homolog	0.0017	0.002	0.0058
Leishmania major	cathepsin L-like protease	0.0063	0.0401	0.0535
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0.002	0.0015
Echinococcus multilocularis	TGF beta signal transducer SmadC	0.0025	0.0085	0.0145
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0063	0.0401	0.0677
Echinococcus granulosus	aminopeptidase N	0.0143	0.1053	0.1799
Leishmania major	aminopeptidase, putative,metallo-peptidase, Clan MA(E), Family M1	0.0042	0.0228	0.0301
Echinococcus granulosus	puromycin sensitive aminopeptidase	0.0015	0.0005	0.0009
Echinococcus granulosus	Smad4	0.0025	0.0085	0.0145
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0021	0.0056	0.0087
Echinococcus granulosus	tumor protein p63	0.0332	0.2596	0.4435
Echinococcus granulosus	puromycin sensitive aminopeptidase	0.0042	0.0228	0.039
Schistosoma mansoni	carbonic anhydrase	0.0272	0.21	0.2832
Schistosoma mansoni	smad	0.0025	0.0085	0.0108
Leishmania major	cathepsin L-like protease	0.0017	0.002	0.002
Schistosoma mansoni	TGF-beta signal transducer Smad2	0.0025	0.0085	0.0108
Echinococcus multilocularis	cathepsin L cysteine protease	0.0017	0.002	0.0034
Leishmania major	cathepsin L-like protease	0.0063	0.0401	0.0535
Echinococcus granulosus	cathepsin l cysteine peptidase	0.0017	0.002	0.0034
Echinococcus granulosus	puromycin sensitive aminopeptidase	0.0042	0.0228	0.039
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0032	0.0143	0.0244
Echinococcus granulosus	semaphorin 5B	0.0016	0.0018	0.003
Entamoeba histolytica	aminopeptidase, putative	0.0042	0.0228	0.0282
Schistosoma mansoni	defective proboscis extension response (dpr)-related	0.0021	0.0056	0.0069
Schistosoma mansoni	hypothetical protein	0.0023	0.007	0.0088
Echinococcus granulosus	smad	0.0025	0.0085	0.0145
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0056	0.0096
Schistosoma mansoni	hypothetical protein	0.0016	0.0018	0.0017
Brugia malayi	Peptidase family M1 containing protein	0.0143	0.1053	0.1791
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0018	0.003
Brugia malayi	Cathepsin L-like precursor	0.0017	0.002	0.0025
Trypanosoma cruzi	carbonic anhydrase-like protein, putative	0.0731	0.5852	1
Brugia malayi	plexin A	0.0046	0.0262	0.0439
Echinococcus granulosus	semaphorin 1A	0.0016	0.0018	0.003
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0344	0.2693	0.4597
Echinococcus multilocularis	puromycin sensitive aminopeptidase	0.0042	0.0228	0.039
Trypanosoma brucei	Aminopeptidase M1, putative	0.0042	0.0228	0.0381
Brugia malayi	Carbonic anhydrase like protein 2 precursor	0.0272	0.21	0.3583
Loa Loa (eye worm)	hypothetical protein	0.0101	0.0709	0.1211
Leishmania major	cathepsin L-like protease	0.0017	0.002	0.002
Echinococcus multilocularis	smad	0.0025	0.0085	0.0145
Echinococcus granulosus	Immunoglobulin	0.0021	0.0056	0.0096
Brugia malayi	Putative carbonic anhydrase 5 precursor	0.0731	0.5852	1
Brugia malayi	hypothetical protein	0.0042	0.0228	0.0381
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0.002	0.0015
Brugia malayi	MH1 domain containing protein	0.0025	0.0085	0.0136
Loa Loa (eye worm)	eukaryotic-type carbonic anhydrase	0.0272	0.21	0.3589
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0056	0.0096
Loa Loa (eye worm)	carbonic anhydrase 3	0.0731	0.5852	1
Schistosoma mansoni	plexin	0.0039	0.0203	0.0268
Loa Loa (eye worm)	TATA binding protein associated factor	0.0015	0.0005	0.0009
Echinococcus granulosus	TGF beta signal transducer SmadC	0.0025	0.0085	0.0145
Brugia malayi	Eukaryotic-type carbonic anhydrase family protein	0.0731	0.5852	1
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0156	0.0267
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.0017	0.002	0.007
Schistosoma mansoni	cathepsin F (C01 family)	0.0017	0.002	0.002
Trypanosoma cruzi	metallo-peptidase, Clan MA(E) Family M1	0.0027	0.0107	0.0175
Echinococcus multilocularis	puromycin sensitive aminopeptidase	0.0042	0.0228	0.039
Brugia malayi	hypothetical protein	0.0021	0.0056	0.0087
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0018	0.003
Loa Loa (eye worm)	Smad1	0.0025	0.0085	0.0145
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0112	0.0192
Trypanosoma brucei	metallo-peptidase, Clan MA(E) Family M1	0.0042	0.0228	0.0381
Schistosoma mansoni	hypothetical protein	0.0272	0.21	0.2832
Onchocerca volvulus		0.0042	0.0228	0.0891
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.0017	0.002	0.0034
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0063	0.0401	0.0677
Loa Loa (eye worm)	hypothetical protein	0.0049	0.0281	0.0481
Echinococcus granulosus	twitchin	0.0026	0.01	0.0171
Schistosoma mansoni	smad1 5 8 and	0.0025	0.0085	0.0108
Toxoplasma gondii	cathepsin CPL	0.0017	0.002	0.007
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.0017	0.002	0.0034
Echinococcus multilocularis	tumor protein p63	0.0332	0.2596	0.4435
Brugia malayi	Papain family cysteine protease containing protein	0.0017	0.002	0.0025
Leishmania major	cysteine peptidase A (CPA)	0.0017	0.002	0.002
Echinococcus granulosus	netrin receptor unc 5	0.0021	0.0055	0.0094
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0056	0.0096
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0.002	0.0015
Trichomonas vaginalis	Clan MA, family M1, aminopeptidase N-like metallopeptidase	0.0042	0.0228	0.0223
Brugia malayi	Smad1	0.0025	0.0085	0.0136
Brugia malayi	Plexin repeat family protein	0.0039	0.0203	0.0339
Echinococcus multilocularis	semaphorin 5B	0.0016	0.0018	0.003
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0005	0.0009
Loa Loa (eye worm)	fibroinase	0.0017	0.002	0.0034
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0.002	0.0015
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0018	0.003
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0017	0.002	0.0015
Onchocerca volvulus	Cathepsin L homolog	0.0017	0.002	0.0058
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0017	0.002	0.0015
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0.002	0.0015
Loa Loa (eye worm)	eukaryotic-type carbonic anhydrase	0.0731	0.5852	1
Entamoeba histolytica	carbonic anhydrase, putative	0.0921	0.7401	1
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.01	0.0701	0.119
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.0017	0.002	0.0015
Schistosoma mansoni	carbonic anhydrase	0.0921	0.7401	1
Schistosoma mansoni	smad1 5 8 and	0.0025	0.0085	0.0108
Trypanosoma cruzi	carbonic anhydrase-like protein, putative	0.0731	0.5852	1
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0005	0.0009
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0018	0.003
Echinococcus granulosus	GPCR family 2	0.0032	0.0143	0.0244
Brugia malayi	Cathepsin L-like precursor	0.0017	0.002	0.0025
Schistosoma mansoni	aminopeptidase PILS (M01 family)	0.0042	0.0228	0.0301
Echinococcus granulosus	carbonic anhydrase II	0.0731	0.5852	1
Echinococcus granulosus	cathepsin l1	0.0017	0.002	0.0034
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0.002	0.0015
Echinococcus multilocularis	carbonic anhydrase	0.0272	0.21	0.3589
Brugia malayi	Eukaryotic-type carbonic anhydrase family protein	0.0272	0.21	0.3583
Mycobacterium leprae	CARBONIC ANHYDRASE (CARBONATE DEHYDRATASE) (CARBONIC DEHYDRATASE)	0.0921	0.7401	0.5
Trypanosoma cruzi	cysteine peptidase, putative	0.0063	0.0401	0.0677
Leishmania major	carbonic anhydrase family protein, putative	0.0921	0.7401	1
Schistosoma mansoni	carbonic anhydrase-related	0.0272	0.21	0.2832
Loa Loa (eye worm)	MH2 domain-containing protein	0.0361	0.2827	0.4831
Loa Loa (eye worm)	hypothetical protein	0.0272	0.21	0.3589
Brugia malayi	MH2 domain containing protein	0.0025	0.0085	0.0136
Onchocerca volvulus		0.0312	0.2434	0.97
Echinococcus multilocularis	mothers against decapentaplegic 5	0.0025	0.0085	0.0145
Onchocerca volvulus	Tyrosine kinase homolog	0.0322	0.2509	1
Brugia malayi	Cathepsin L-like precursor	0.0017	0.002	0.0025
Leishmania major	aminopeptidase-like protein,metallo-peptidase, Clan MA(E), Family M1	0.0042	0.0228	0.0301
Echinococcus multilocularis	Immunoglobulin	0.0021	0.0056	0.0096
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.0017	0.002	0.007
Plasmodium vivax	vivapain-2	0.0017	0.002	1
Brugia malayi	Eukaryotic-type carbonic anhydrase family protein	0.0272	0.21	0.3583
Loa Loa (eye worm)	cysteine protease	0.0017	0.002	0.0034
Trypanosoma cruzi	Aminopeptidase M1, putative	0.0042	0.0228	0.0381
Loa Loa (eye worm)	hypothetical protein	0.0016	0.0018	0.003
Schistosoma mansoni	cathepsin F (C01 family)	0.0017	0.002	0.002
Schistosoma mansoni	hypothetical protein	0.0032	0.0143	0.0186
Loa Loa (eye worm)	sema domain-containing protein	0.0016	0.0018	0.003
Brugia malayi	Cathepsin L-like precursor	0.0017	0.002	0.0025
Mycobacterium ulcerans	carbonic anhydrase	0.0921	0.7401	0.74
Brugia malayi	Calcitonin receptor-like protein seb-1	0.01	0.0701	0.119
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.01	0.0701	0.1198
Echinococcus multilocularis	aminopeptidase N	0.0143	0.1053	0.1799
Echinococcus multilocularis	puromycin sensitive aminopeptidase	0.0042	0.0228	0.039
Echinococcus granulosus	carbonic anhydrase	0.0272	0.21	0.3589
Loa Loa (eye worm)	MH2 domain-containing protein	0.0025	0.0085	0.0145
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.0017	0.002	0.0015
Echinococcus multilocularis	microtubule associated protein 2	0.07	0.56	0.9569
Onchocerca volvulus		0.0017	0.002	0.0058
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0107	0.0183
Echinococcus granulosus	nuclear factor of activated T cells 5	0.0072	0.0472	0.0806
Brugia malayi	Carbonic anhydrase like protein 2 precursor	0.0272	0.21	0.3583
Schistosoma mansoni	hypothetical protein	0.0068	0.0443	0.0591
Echinococcus multilocularis	leukotriene A 4 hydrolase	0.0015	0.0005	0.0009
Echinococcus granulosus	microtubule associated protein 2	0.07	0.56	0.9569
Loa Loa (eye worm)	hypothetical protein	0.0272	0.21	0.3589
Onchocerca volvulus		0.0017	0.002	0.0058
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0032	0.0143	0.0235
Loa Loa (eye worm)	hypothetical protein	0.0128	0.0932	0.1592
Brugia malayi	hypothetical protein	0.0016	0.0018	0.0021
Loa Loa (eye worm)	sema domain-containing protein	0.0016	0.0018	0.003
Plasmodium falciparum	cysteine proteinase falcipain 3	0.0017	0.002	0.007
Echinococcus multilocularis	carbonic anhydrase	0.0272	0.21	0.3589
Trichomonas vaginalis	Clan MA, family M1, aminopeptidase N-like metallopeptidase	0.0042	0.0228	0.0223
Echinococcus granulosus	puromycin sensitive aminopeptidase	0.0015	0.0005	0.0009
Trypanosoma cruzi	cysteine peptidase, putative	0.0063	0.0401	0.0677
Onchocerca volvulus		0.0049	0.0281	0.1102
Echinococcus granulosus	neurotracting:lsamp:neurotrimin:obcam	0.0028	0.0112	0.0192
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0.002	0.0015
Plasmodium falciparum	carbonic anhydrase	0.0272	0.21	1
Echinococcus granulosus	mothers against decapentaplegic 5	0.0025	0.0085	0.0145
Echinococcus multilocularis	cathepsin L cysteine protease	0.0017	0.002	0.0034
Echinococcus multilocularis	carbonic anhydrase II	0.0731	0.5852	1
Schistosoma mansoni	netrin receptor unc5	0.0021	0.0055	0.0067
Onchocerca volvulus		0.0017	0.002	0.0058
Trypanosoma brucei	carbonic anhydrase-like protein	0.0731	0.5852	1
Trypanosoma cruzi	cruzipain precursor, putative	0.0063	0.0401	0.0677
Onchocerca volvulus		0.0143	0.1053	0.4183
Echinococcus granulosus	cathepsin L cysteine proteinase	0.0017	0.002	0.0034
Brugia malayi	Cathepsin L-like precursor	0.0017	0.002	0.0025
Toxoplasma gondii	hypothetical protein	0.0272	0.21	1
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0032	0.0143	0.0244
Loa Loa (eye worm)	hypothetical protein	0.0017	0.002	0.0034
Echinococcus multilocularis	puromycin sensitive aminopeptidase	0.0042	0.0228	0.039
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0143	0.0244
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0021	0.0055	0.0085
Brugia malayi	Sema domain containing protein	0.0016	0.0018	0.0021
Schistosoma mansoni	hypothetical protein	0.0032	0.0143	0.0186
Schistosoma mansoni	carbonic anhydrase II (carbonate dehydratase II)	0.0731	0.5852	0.7905
Brugia malayi	Eukaryotic-type carbonic anhydrase family protein	0.0272	0.21	0.3583
Schistosoma mansoni	cellular tumor antigen P53	0.0049	0.0281	0.0373
Leishmania major	cathepsin L-like protease	0.0017	0.002	0.002
Schistosoma mansoni	Neurotrimin precursor (hNT)	0.0021	0.0056	0.0069
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0032	0.0143	0.0244
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0063	0.0401	0.0677
Echinococcus granulosus	roundabout 2	0.0033	0.0156	0.0267
Plasmodium vivax	vivapain-2	0.0017	0.002	1
Leishmania major	cathepsin L-like protease	0.0017	0.002	0.002
Loa Loa (eye worm)	hypothetical protein	0.0023	0.007	0.012
Echinococcus multilocularis	GPCR, family 2	0.0032	0.0143	0.0244
Onchocerca volvulus		0.0017	0.002	0.0058
Schistosoma mansoni	cell adhesion molecule	0.0028	0.0112	0.0145
Loa Loa (eye worm)	leukotriene A4 hydrolase	0.0015	0.0005	0.0009
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0063	0.0401	0.0677
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0203	0.0348
Onchocerca volvulus		0.0017	0.002	0.0058
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0063	0.0401	0.0677
Brugia malayi	Cathepsin L-like precursor	0.0017	0.002	0.0025
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.0058	0.0356	0.06
Echinococcus granulosus	plexin a4	0.0046	0.0262	0.0448
Leishmania major	cathepsin L-like protease	0.0063	0.0401	0.0535
Echinococcus multilocularis	plexin a4	0.0046	0.0262	0.0448
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0017	0.002	0.0015
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0005	0.0009
Echinococcus multilocularis	Peptidase M1, membrane alanine aminopeptidase, N terminal	0.0042	0.0228	0.039
Brugia malayi	Peptidase family M1 containing protein	0.0042	0.0228	0.0381
Loa Loa (eye worm)	hypothetical protein	0.0021	0.0056	0.0096
Schistosoma mansoni	carbonic anhydrase-related	0.0272	0.21	0.2832
Echinococcus multilocularis	cysteine protease	0.0017	0.002	0.0034
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.0063	0.0401	0.0677
Loa Loa (eye worm)	TK/KIN16 protein kinase	0.0344	0.2693	0.4602
Trypanosoma cruzi	cysteine peptidase, putative	0.0063	0.0401	0.0677
Echinococcus multilocularis	puromycin sensitive aminopeptidase	0.0027	0.0107	0.0183
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0032	0.0143	0.0244

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 5.1 uM	Inhibition of aminopeptidase N in pig kidney microsome by spectrophotometry	ChEMBL.	19454370
IC50 (binding)	= 236.3 uM	Inhibition of MMP2	ChEMBL.	19454370

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: CHEMBL578859

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1077628