TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 429.62 | Formula: C27H31N3S
H donors: 1 H acceptors: 1 LogP: 7.34 Rotable bonds: 4
Rule of 5 violations (Lipinski): 1
SMILES: c1ccc(cc1)Nc1sc2c(n1)cc1c(c2)C[C@@H]2[C@H]3[C@@]1(CCCC3)CCN2CC1CC1
InChi: 1S/C27H31N3S/c1-2-6-20(7-3-1)28-26-29-23-16-22-19(15-25(23)31-26)14-24-21-8-4-5-11-27(21,22)12-13-30(24)17-18-9-10-18/h1-3,6-7,15-16,18,21,24H,4-5,8-14,17H2,(H,28,29)/t21-,24+,27+/m0/s1
InChiKey: GDHHTYKFZFDQPE-YEEURNOCSA-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
Homo sapiens	opioid receptor, mu 1	Starlite/ChEMBL	References
Homo sapiens	opioid receptor, kappa 1	Starlite/ChEMBL	References
Homo sapiens	opioid receptor, delta 1	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	Get druggable targets OG5_139759	All targets in OG5_139759
Echinococcus granulosus	tm gpcr rhodopsin	Get druggable targets OG5_139759	All targets in OG5_139759

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
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0231	0.1799	0.8387
Giardia lamblia	Ubiquitin carboxyl-terminal hydrolase 4	0.0039	0.0239	0.1089
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0017	0.0061	0.0111
Trypanosoma cruzi	hypothetical protein, conserved	0.0056	0.0375	0.1351
Brugia malayi	Carboxylesterase family protein	0.0082	0.0587	0.1068
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0214	0.0389
Loa Loa (eye worm)	acetylcholinesterase 1	0.0485	0.3868	0.7042
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0017	0.0061	0.0111
Loa Loa (eye worm)	protein tyrosine phosphatase	0.0017	0.0061	0.0111
Echinococcus multilocularis	Receptor type tyrosine protein phosphatase O	0.0017	0.0061	0.0111
Leishmania major	ATP-dependent DEAD/H DNA helicase recQ, putative	0.0019	0.0077	0.0072
Trypanosoma brucei	importin beta-1 subunit, putative	0.0029	0.0155	0.0405
Brugia malayi	Protein-tyrosine phosphatase	0.0017	0.0061	0.0111
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0017	0.0061	0.0111
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0017	0.0061	0.0111
Trichomonas vaginalis	Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase	0.0039	0.0239	0.1089
Onchocerca volvulus		0.0017	0.0061	0.0359
Brugia malayi	RNA, U transporter 1	0.0082	0.0589	0.1073
Trichomonas vaginalis	esterase, putative	0.0036	0.0214	0.0936
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0017	0.0061	0.0111
Echinococcus granulosus	ATP dependent DNA helicase Q1	0.0019	0.0077	0.0141
Trypanosoma cruzi	ubiquitin carboxyl-terminal hydrolase, putative	0.0039	0.0239	0.0764
Brugia malayi	hypothetical protein	0.0017	0.0061	0.0111
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.0017	0.0061	0.0111
Echinococcus multilocularis	receptor type tyrosine protein phosphatase protein tyrosine phosphatase receptor type	0.0017	0.0061	0.0111
Schistosoma mansoni	DNA helicase recq1	0.0019	0.0077	0.0077
Plasmodium falciparum	ATP-dependent DNA helicase Q1	0.0019	0.0077	0.0626
Leishmania major	basic transcription factor 3a, putative	0.0034	0.0198	0.059
Leishmania major	hypothetical protein, conserved	0.0056	0.0375	0.1351
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0684	0.5492	1
Onchocerca volvulus		0.0017	0.0061	0.0359
Echinococcus granulosus	ATP dependent DNA helicase Q5	0.0019	0.0077	0.0141
Echinococcus multilocularis	carboxylesterase 5A	0.0485	0.3868	0.7042
Entamoeba histolytica	hypothetical protein	0.0023	0.0111	0.0653
Echinococcus granulosus	DNA apurinic or apyrimidinic site lyase	0.0018	0.0069	0.0126
Onchocerca volvulus		0.0017	0.0061	0.0359
Treponema pallidum	exodeoxyribonuclease (exoA)	0.0018	0.0069	0.5
Echinococcus granulosus	receptor type tyrosine protein phosphatase zeta	0.0017	0.0061	0.0111
Trypanosoma cruzi	mitochondrial DNA polymerase beta, putative	0.0303	0.2387	1
Mycobacterium ulcerans	esterase/lipase LipP	0.0036	0.0214	0.07
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0214	0.0389
Echinococcus multilocularis	family S9 non peptidase ue (S09 family)	0.0082	0.0587	0.1068
Echinococcus granulosus	glycogen phosphorylase	0.0218	0.1693	0.3083
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0036	0.0214	0.0389
Trichomonas vaginalis	DNA helicase recq1, putative	0.0019	0.0077	0.0102
Echinococcus granulosus	para nitrobenzyl esterase	0.0082	0.0587	0.1068
Trypanosoma cruzi	hypothetical protein, conserved	0.0036	0.0214	0.0657
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0017	0.0061	0.0111
Entamoeba histolytica	ubiquitin carboxyl-terminal hydrolase domain containing protein	0.0039	0.0239	0.1409
Echinococcus granulosus	Receptor type tyrosine protein phosphatase O	0.0017	0.0061	0.0111
Schistosoma mansoni	glycogen phosphorylase	0.0094	0.0686	0.0686
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.0017	0.0061	0.0111
Schistosoma mansoni	receptor protein tyrosine phosphatase r (pcptp1)	0.0017	0.0061	0.0061
Mycobacterium ulcerans	hypothetical protein	0.016	0.1219	0.5576
Schistosoma mansoni	importin beta-1	0.0029	0.0155	0.0155
Onchocerca volvulus		0.0082	0.0587	0.3464
Schistosoma mansoni	DNA helicase recq5	0.0019	0.0077	0.0077
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0017	0.0061	0.0111
Echinococcus multilocularis	Glycosyl transferase, family 35	0.0218	0.1693	0.3083
Trypanosoma cruzi	DNA polymerase beta thumb, putative	0.0043	0.0266	0.0884
Brugia malayi	carbohydrate phosphorylase	0.0218	0.1693	0.3083
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0017	0.0061	0.0111
Echinococcus multilocularis	tyrosine protein phosphatase non receptor type	0.0017	0.0061	0.0111
Schistosoma mansoni	BC026374 protein (S09 family)	0.0082	0.0587	0.0587
Echinococcus multilocularis		0.0017	0.0061	0.0111
Echinococcus multilocularis	neuroligin	0.0082	0.0587	0.1068
Trypanosoma brucei	apurinic/apyrimidinic endonuclease, putative	0.0018	0.0069	0.0037
Trichomonas vaginalis	low molecular weight protein tyrosine phosphatase, putative	0.0182	0.1397	0.8189
Loa Loa (eye worm)	hypothetical protein	0.0082	0.0587	0.1068
Echinococcus multilocularis	tyrosine protein phosphatase non receptor type	0.0017	0.0061	0.0111
Trypanosoma cruzi	mitochondrial DNA polymerase beta-PAK, putative	0.0043	0.0266	0.0884
Echinococcus granulosus	ubiquitin specific protease 41	0.0039	0.0239	0.0434
Trichomonas vaginalis	low molecular weight protein tyrosine phosphatase, putative	0.0056	0.0375	0.1925
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0017	0.0061	0.0111
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.0017	0.0061	0.0111
Mycobacterium ulcerans	short chain dehydrogenase	0.0272	0.2131	1
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0036	0.0214	0.0214
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0036	0.0214	0.0389
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0061	0.0111
Brugia malayi	beta-lactamase family protein	0.0036	0.0214	0.0389
Mycobacterium tuberculosis	Probable conserved lipoprotein	0.0036	0.0214	0.07
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0017	0.0061	0.0111
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0082	0.0587	0.2509
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0061	0.0111
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.0017	0.0061	0.0111
Echinococcus granulosus	ubiquitin carboxyl terminal hydrolase 8	0.0039	0.0239	0.0434
Mycobacterium leprae	Probable lipase LipE	0.0036	0.0214	0.5
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0684	0.5492	1
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0214	0.0389
Mycobacterium tuberculosis	Phosphotyrosine protein phosphatase PtpA (protein-tyrosine-phosphatase) (PTPase) (LMW phosphatase)	0.0126	0.0942	0.4232
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0061	0.0111
Trypanosoma cruzi	hypothetical protein, conserved	0.0036	0.0214	0.0657
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0017	0.0061	0.0111
Mycobacterium tuberculosis	Probable esterase LipL	0.0036	0.0214	0.07
Trichomonas vaginalis	Importin beta-1 subunit, putative	0.0023	0.0111	0.0305
Loa Loa (eye worm)	nucleolar RNA-associated protein alpha	0.0309	0.2434	0.4432
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0017	0.0061	0.0111
Trypanosoma brucei	mitochondrial DNA polymerase beta	0.0303	0.2387	1
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0485	0.3868	0.3868
Onchocerca volvulus		0.0036	0.0214	0.1261
Plasmodium vivax	hypothetical protein, conserved	0.0036	0.0214	1
Brugia malayi	Carboxylesterase family protein	0.0082	0.0587	0.1068
Echinococcus granulosus	beta LACTamase domain containing family member	0.0036	0.0214	0.0389
Onchocerca volvulus		0.0017	0.0061	0.0359
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0017	0.0061	0.0111
Onchocerca volvulus		0.0017	0.0061	0.0359
Brugia malayi	Carboxylesterase family protein	0.0485	0.3868	0.7042
Giardia lamblia	Low molecular weight protein-tyrosine-phosphatase	0.0182	0.1397	0.8189
Entamoeba histolytica	transcription factor BTF3, putative	0.0034	0.0198	0.117
Echinococcus granulosus	tm gpcr rhodopsin	0.0634	0.5079	0.9247
Mycobacterium ulcerans	glycogen phosphorylase GlgP	0.0094	0.0686	0.2993
Leishmania major	importin beta-1 subunit, putative	0.0023	0.0111	0.0214
Mycobacterium ulcerans	beta-lactamase	0.0036	0.0214	0.07
Trypanosoma cruzi	ubiquitin carboxyl-terminal hydrolase, putative	0.0039	0.0239	0.0764
Onchocerca volvulus		0.0017	0.0061	0.0359
Echinococcus granulosus	BC026374 protein S09 family	0.0082	0.0587	0.1068
Brugia malayi	Carboxylesterase family protein	0.0082	0.0587	0.1068
Trichomonas vaginalis	spcc417.12 protein, putative	0.0082	0.0587	0.3221
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0061	0.0111
Brugia malayi	hypothetical protein	0.0017	0.0061	0.0111
Schistosoma mansoni	receptor tyrosine phosphatase type r2a	0.0017	0.0061	0.0061
Mycobacterium tuberculosis	Probable lipase LipE	0.0036	0.0214	0.07
Trichomonas vaginalis	penicillin-binding protein, putative	0.0036	0.0214	0.0936
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease	0.0018	0.0069	0.0037
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0214	0.0389
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0082	0.0587	0.0587
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.0017	0.0061	0.0111
Echinococcus multilocularis	Peptidase C19, ubiquitin carboxyl terminal hydrolase 2	0.0039	0.0239	0.0434
Entamoeba histolytica	exodeoxyribonuclease III, putative	0.0018	0.0069	0.041
Schistosoma mansoni	receptor protein tyrosine phosphatase	0.0017	0.0061	0.0061
Brugia malayi	hypothetical protein	0.0017	0.0061	0.0111
Mycobacterium tuberculosis	Possible conserved lipoprotein LpqK	0.0036	0.0214	0.07
Onchocerca volvulus		0.0036	0.0214	0.1261
Onchocerca volvulus		0.0017	0.0061	0.0359
Mycobacterium tuberculosis	Conserved hypothetical protein	0.016	0.1219	0.5576
Schistosoma mansoni	protein tyrosine phosphatase	0.0017	0.0061	0.0061
Echinococcus multilocularis	glycogen phosphorylase	0.0218	0.1693	0.3083
Leishmania major	ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative	0.0039	0.0239	0.0764
Trichomonas vaginalis	DNA helicase recq, putative	0.0019	0.0077	0.0102
Trichomonas vaginalis	glycogen phosphorylase, putative	0.0218	0.1693	1
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0061	0.0111
Plasmodium vivax	importin-beta 2, putative	0.0029	0.0155	0.7258
Echinococcus granulosus	neuroligin	0.0082	0.0587	0.1068
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0017	0.0061	0.0111
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0061	0.0111
Loa Loa (eye worm)	carboxylesterase	0.0082	0.0587	0.1068
Onchocerca volvulus		0.0082	0.0587	0.3464
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0061	0.0111
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0036	0.0214	0.0214
Plasmodium falciparum	basic transcription factor 3b, putative	0.0034	0.0198	1
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0061	0.0111
Trypanosoma brucei	ATP-dependent DEAD/H DNA helicase recQ, putative	0.0019	0.0077	0.0072
Loa Loa (eye worm)	exodeoxyribonuclease III family protein	0.0018	0.0069	0.0126
Loa Loa (eye worm)	hypothetical protein	0.0082	0.0587	0.1068
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.0017	0.0061	0.0111
Giardia lamblia	Glycogen phosphorylase	0.0218	0.1693	1
Trypanosoma brucei	mitochondrial DNA polymerase beta-PAK	0.0143	0.1087	0.4413
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0082	0.0587	0.0587
Giardia lamblia	Endonuclease/Exonuclease/phosphatase	0.0018	0.0069	0.0052
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0017	0.0061	0.0111
Schistosoma mansoni	protein tyrosine phosphatase n11 (shp2)	0.0017	0.0061	0.0061
Echinococcus multilocularis	bloom syndrome protein	0.0019	0.0077	0.0141
Loa Loa (eye worm)	hypothetical protein	0.0082	0.0587	0.1068
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.0017	0.0061	0.0111
Onchocerca volvulus		0.0017	0.0061	0.0359
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0155	0.0282
Echinococcus multilocularis	tyrosine protein phosphatase non receptor type	0.0684	0.5492	1
Trypanosoma cruzi	DNA polymerase beta thumb, putative	0.0043	0.0266	0.0884
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.0017	0.0061	0.0111
Mycobacterium tuberculosis	Probable oxidoreductase	0.0272	0.2131	1
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0061	0.0111
Echinococcus multilocularis	Receptor type tyrosine protein phosphatase O	0.0017	0.0061	0.0111
Trichomonas vaginalis	low molecular weight protein tyrosine phosphatase, putative	0.0182	0.1397	0.8189
Onchocerca volvulus		0.0017	0.0061	0.0359
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0017	0.0061	0.0111
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0017	0.0061	0.0111
Schistosoma mansoni	receptor tyrosine phosphatase type r2a	0.0017	0.0061	0.0061
Echinococcus multilocularis	DNA (apurinic or apyrimidinic site) lyase	0.0018	0.0069	0.0126
Mycobacterium tuberculosis	Conserved protein	0.0036	0.0214	0.07
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0017	0.0061	0.0111
Leishmania major	mitochondrial DNA polymerase beta	0.0303	0.2387	1
Plasmodium vivax	AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative	0.0018	0.0069	0.3247
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0061	0.0111
Echinococcus granulosus	receptor type tyrosine protein phosphatase zeta	0.0017	0.0061	0.0111
Entamoeba histolytica	protein tyrosine phosphatase, putative	0.0182	0.1397	0.8254
Echinococcus granulosus	importin subunit beta 1	0.0029	0.0155	0.0282
Toxoplasma gondii	NAC domain-containing protein	0.0034	0.0198	0.6241
Toxoplasma gondii	exonuclease III APE	0.0018	0.0069	0.2185
Brugia malayi	hypothetical protein	0.0017	0.0061	0.0111
Trypanosoma brucei	low molecular weight protein tyrosine phosphatase, putative	0.0056	0.0375	0.1351
Echinococcus multilocularis	glycogen phosphorylase	0.0218	0.1693	0.3083
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.0017	0.0061	0.0111
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0077	0.0141
Loa Loa (eye worm)	hypothetical protein	0.0082	0.0587	0.1068
Trichomonas vaginalis	D-aminoacylase, putative	0.0036	0.0214	0.0936
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0061	0.0111
Plasmodium vivax	basic transcription factor 3b, putative	0.0034	0.0198	0.9273
Schistosoma mansoni	protein tyrosine phosphatase	0.0017	0.0061	0.0061
Entamoeba histolytica	protein tyrosine phosphatase, putative	0.0182	0.1397	0.8254
Echinococcus granulosus	protein tyrosine phosphatase n9	0.0017	0.0061	0.0111
Mycobacterium tuberculosis	Probable glycogen phosphorylase GlgP	0.0094	0.0686	0.2993
Echinococcus granulosus	acetylcholinesterase	0.0485	0.3868	0.7042
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0214	0.0389
Trichomonas vaginalis	low molecular weight protein-tyrosine-phosphatase, putative	0.0182	0.1397	0.8189
Brugia malayi	exodeoxyribonuclease III family protein	0.0018	0.0069	0.0126
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.0017	0.0061	0.0111
Echinococcus granulosus	snurportin 1	0.0309	0.2434	0.4432
Echinococcus multilocularis	tm gpcr rhodopsin gpcr rhodopsin superfamily	0.0634	0.5079	0.9247
Schistosoma mansoni	protein-tyrosine phosphatase n9	0.0017	0.0061	0.0061
Trichomonas vaginalis	conserved hypothetical protein	0.0034	0.0198	0.0841
Echinococcus multilocularis	Receptor type tyrosine protein phosphatase O	0.0017	0.0061	0.0111
Mycobacterium tuberculosis	Probable esterase/lipase LipP	0.0036	0.0214	0.07
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0017	0.0061	0.0111
Onchocerca volvulus	Glycogen phosphorylase homolog	0.0218	0.1693	1
Mycobacterium tuberculosis	Probable hydrolase	0.0036	0.0214	0.07
Trypanosoma cruzi	ATP-dependent DEAD/H DNA helicase recQ, putative	0.0019	0.0077	0.0072
Echinococcus granulosus	Receptor type tyrosine protein phosphatase O	0.0017	0.0061	0.0111
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.0017	0.0061	0.0111
Schistosoma mansoni	ubiquitin-specific peptidase 8 (C19 family)	0.0039	0.0239	0.0239
Echinococcus multilocularis	ubiquitin specific protease 41	0.0039	0.0239	0.0434
Loa Loa (eye worm)	beta-lactamase	0.0036	0.0214	0.0389
Onchocerca volvulus		0.0082	0.0587	0.3464
Echinococcus granulosus	carboxylesterase 5A	0.0485	0.3868	0.7042
Entamoeba histolytica	protein tyrosine phosphatase, putative	0.0017	0.0061	0.0359
Trypanosoma brucei	hypothetical protein, conserved	0.0036	0.0214	0.0657
Brugia malayi	beta-NAC-like protein	0.0034	0.0198	0.0361
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0017	0.0061	0.0111
Schistosoma mansoni	acetylcholinesterase	0.0082	0.0587	0.0587
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0017	0.0061	0.0111
Mycobacterium tuberculosis	Conserved protein	0.0036	0.0214	0.07
Toxoplasma gondii	ABC1 family protein	0.0036	0.0214	0.673
Echinococcus granulosus	glycogen phosphorylase	0.0218	0.1693	0.3083
Trichomonas vaginalis	importin beta-1, putative	0.0023	0.0111	0.0305
Onchocerca volvulus		0.0017	0.0061	0.0359
Onchocerca volvulus		0.0017	0.0061	0.0359
Trichomonas vaginalis	ap endonuclease, putative	0.0018	0.0069	0.0052
Trypanosoma cruzi	hypothetical protein, conserved	0.0056	0.0375	0.1351
Trichomonas vaginalis	glycogen phosphorylase, putative	0.0218	0.1693	1
Loa Loa (eye worm)	ATP-dependent DNA helicase	0.0019	0.0077	0.0141
Echinococcus multilocularis	BC026374 protein (S09 family)	0.0082	0.0587	0.1068
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.0017	0.0061	0.0111
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0017	0.0061	0.0111
Echinococcus multilocularis	receptor type tyrosine protein phosphatase protein tyrosine phosphatase receptor type	0.0017	0.0061	0.0111
Onchocerca volvulus	4.1 G protein, putative homolog	0.0017	0.0061	0.0359
Toxoplasma gondii	hypothetical protein	0.0049	0.0317	1
Chlamydia trachomatis	glycogen phosphorylase	0.0218	0.1693	0.5
Toxoplasma gondii	ATP-dependent DNA helicase, RecQ family protein	0.0019	0.0077	0.2439
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0061	0.0111
Loa Loa (eye worm)	protein-tyrosine-phosphatase	0.0017	0.0061	0.0111
Entamoeba histolytica	glycogen phosphorylase, putative	0.0094	0.0686	0.4054
Onchocerca volvulus		0.0017	0.0061	0.0359
Loa Loa (eye worm)	carboxylesterase	0.0082	0.0587	0.1068
Onchocerca volvulus		0.0017	0.0061	0.0359
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0017	0.0061	0.0111
Onchocerca volvulus		0.0082	0.0587	0.3464
Echinococcus multilocularis	ATP dependent DNA helicase Q5	0.0019	0.0077	0.0141
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.0017	0.0061	0.0111
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0017	0.0061	0.0111
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0017	0.0061	0.0111
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0061	0.0111
Echinococcus multilocularis	ATP dependent DNA helicase Q1	0.0019	0.0077	0.0141
Entamoeba histolytica	Pten 3-phosphoinositide phosphatase, putative	0.0017	0.0061	0.0359
Onchocerca volvulus		0.0017	0.0061	0.0359
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0082	0.0587	0.2509
Brugia malayi	beta-lactamase	0.0036	0.0214	0.0389
Trypanosoma cruzi	transcription factor btf3, putative	0.0034	0.0198	0.059
Trichomonas vaginalis	Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase	0.0039	0.0239	0.1089
Schistosoma mansoni	ubiquitin-specific peptidase 2 (C19 family)	0.0039	0.0239	0.0239
Schistosoma mansoni	receptor tyrosine phosphatase type r2a	0.0017	0.0061	0.0061
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.0017	0.0061	0.0111
Echinococcus granulosus	bloom syndrome protein	0.0019	0.0077	0.0141
Trichomonas vaginalis	low molecular weight protein-tyrosine-phosphatase, putative	0.0182	0.1397	0.8189
Trypanosoma cruzi	transcription factor btf3, putative	0.0034	0.0198	0.059
Echinococcus granulosus	transcription factor btf3	0.0034	0.0198	0.0361
Schistosoma mansoni	protein tyrosine phosphatase non-receptor type nt1	0.0684	0.5492	0.5492
Brugia malayi	Carboxylesterase family protein	0.0485	0.3868	0.7042
Echinococcus granulosus	Glycosyl transferase family 35	0.0218	0.1693	0.3083
Leishmania major	hypothetical protein, conserved	0.0036	0.0214	0.0657
Schistosoma mansoni	transcription factor btf3	0.0034	0.0198	0.0198
Echinococcus multilocularis	acetylcholinesterase	0.0485	0.3868	0.7042
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.0017	0.0061	0.0111
Trypanosoma brucei	importin beta-1 subunit, putative	0.0029	0.0155	0.0405
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0061	0.0111
Onchocerca volvulus		0.0017	0.0061	0.0359
Schistosoma mansoni	protein tyrosine phosphatase	0.0017	0.0061	0.0061
Loa Loa (eye worm)	phosphotyrosine protein phosphatase	0.0182	0.1397	0.2544
Trichomonas vaginalis	ap endonuclease, putative	0.0018	0.0069	0.0052
Echinococcus granulosus	Peptidase C19 ubiquitin carboxyl terminal hydrolase 2	0.0039	0.0239	0.0434
Brugia malayi	Ubiquitin carboxyl-terminal hydrolase family protein	0.0039	0.0239	0.0434
Entamoeba histolytica	glycogen phosphorylase, putative	0.0218	0.1693	1
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0061	0.0111
Loa Loa (eye worm)	carboxylesterase	0.0485	0.3868	0.7042
Mycobacterium tuberculosis	Conserved protein	0.0036	0.0214	0.07
Echinococcus multilocularis	Receptor type tyrosine protein phosphatase O	0.0017	0.0061	0.0111
Brugia malayi	Dual specificity protein phosphatase CDC14B	0.0017	0.0061	0.0111
Mycobacterium tuberculosis	Carboxylesterase LipT	0.0082	0.0587	0.2509
Loa Loa (eye worm)	dual specificity protein phosphatase CDC14B	0.0017	0.0061	0.0111
Brugia malayi	Low molecular weight phosphotyrosine protein phosphatase containing protein	0.0182	0.1397	0.2544
Loa Loa (eye worm)	protein-tyrosine phosphatase 1	0.0017	0.0061	0.0111
Entamoeba histolytica	glycogen phosphorylase, putative	0.0094	0.0686	0.4054
Trichomonas vaginalis	D-aminoacylase, putative	0.0036	0.0214	0.0936
Plasmodium falciparum	ADP-dependent DNA helicase RecQ	0.0019	0.0077	0.0626
Echinococcus multilocularis	tyrosine protein phosphatase non receptor type	0.0017	0.0061	0.0111
Trypanosoma cruzi	mitochondrial DNA polymerase beta, putative	0.0303	0.2387	1
Entamoeba histolytica	hypothetical protein	0.0034	0.0198	0.117
Loa Loa (eye worm)	fibronectin type III domain-containing protein	0.0017	0.0061	0.0111
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0061	0.0111
Echinococcus granulosus	family S9 non peptidase ue S09 family	0.0082	0.0587	0.1068
Trichomonas vaginalis	DNA helicase recq, putative	0.0019	0.0077	0.0102
Onchocerca volvulus		0.0017	0.0061	0.0359
Onchocerca volvulus		0.0017	0.0061	0.0359
Schistosoma mansoni	receptor protein tyrosine phosphatase n (ia2)	0.0017	0.0061	0.0061
Brugia malayi	beta-lactamase family protein	0.0036	0.0214	0.0389
Plasmodium falciparum	importin beta, putative	0.0029	0.0155	0.6657
Mycobacterium ulcerans	phosphotyrosine protein phosphatase PtpA	0.0182	0.1397	0.6442
Brugia malayi	ATP-dependent DNA helicase, RecQ family protein	0.0019	0.0077	0.0141
Schistosoma mansoni	neuroligin 3 (S09 family)	0.0082	0.0587	0.0587
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0017	0.0061	0.0111
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0017	0.0061	0.0111
Brugia malayi	Protein-tyrosine phosphatase 1	0.0017	0.0061	0.0111
Brugia malayi	ATP-dependent DNA helicase, RecQ family protein	0.0019	0.0077	0.0141
Wolbachia endosymbiont of Brugia malayi	exonuclease III	0.0018	0.0069	0.5
Schistosoma mansoni	ap endonuclease	0.0018	0.0069	0.0069
Onchocerca volvulus		0.0036	0.0214	0.1261
Mycobacterium ulcerans	hypothetical protein	0.0036	0.0214	0.07
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0061	0.0111
Mycobacterium leprae	conserved hypothetical protein	0.0036	0.0214	0.5
Schistosoma mansoni	family A2 unassigned peptidase (A02 family)	0.0225	0.1752	0.1752
Echinococcus multilocularis	importin subunit beta 1	0.0029	0.0155	0.0282
Brugia malayi	Carboxylesterase family protein	0.0082	0.0587	0.1068
Entamoeba histolytica	protein tyrosine phosphatase, putative	0.0017	0.0061	0.0359
Trypanosoma cruzi	mitochondrial DNA polymerase beta-PAK, putative	0.0052	0.0342	0.121
Onchocerca volvulus		0.0017	0.0061	0.0359
Brugia malayi	hypothetical protein	0.0082	0.0587	0.1068
Toxoplasma gondii	HEAT repeat-containing protein	0.0029	0.0155	0.4885
Trichomonas vaginalis	conserved hypothetical protein	0.0039	0.0239	0.1089
Giardia lamblia	Sgs1 DNA helicase, putative	0.0019	0.0077	0.0102
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0061	0.0111
Onchocerca volvulus		0.0082	0.0587	0.3464
Schistosoma mansoni	gliotactin	0.0082	0.0587	0.0587
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0061	0.0111
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0061	0.0111
Brugia malayi	protein-tyrosine phosphatase Lar-like precursor, putative	0.0017	0.0061	0.0111
Echinococcus multilocularis	receptor type tyrosine protein phosphatase H	0.0017	0.0061	0.0111
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0082	0.0587	0.0587
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0061	0.0111
Trypanosoma brucei	DNA polymerase beta thumb, putative	0.0043	0.0266	0.0884
Onchocerca volvulus		0.0182	0.1397	0.8254
Mycobacterium ulcerans	fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE	0.0036	0.0214	0.07
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0017	0.0061	0.0111
Trichomonas vaginalis	low molecular weight protein-tyrosine-phosphatase, putative	0.0182	0.1397	0.8189
Leishmania major	mitochondrial DNA polymerase beta-PAK, putative	0.0143	0.1087	0.4413
Schistosoma mansoni	glycogen phosphorylase	0.0218	0.1693	0.1693
Trichomonas vaginalis	Importin beta-1 subunit, putative	0.0023	0.0111	0.0305
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0061	0.0111
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0061	0.0111
Trichomonas vaginalis	carboxylesterase domain containing protein, putative	0.0082	0.0587	0.3221
Loa Loa (eye worm)	hypothetical protein	0.0082	0.0587	0.1068
Loa Loa (eye worm)	RecQ helicase	0.0019	0.0077	0.0141
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.0017	0.0061	0.0111
Entamoeba histolytica	recQ family helicase, putative	0.0019	0.0077	0.0457
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0017	0.0061	0.0111
Brugia malayi	Protein-tyrosine phosphatase	0.0017	0.0061	0.0111
Leishmania major	apurinic/apyrimidinic endonuclease-redox protein	0.0018	0.0069	0.0037
Loa Loa (eye worm)	hypothetical protein	0.0485	0.3868	0.7042
Loa Loa (eye worm)	glycogen phosphorylase	0.0218	0.1693	0.3083
Mycobacterium tuberculosis	Probable lipase LipD	0.0036	0.0214	0.07
Trichomonas vaginalis	penicillin-binding protein, putative	0.0036	0.0214	0.0936
Echinococcus multilocularis	protein tyrosine phosphatase n9	0.0017	0.0061	0.0111
Loa Loa (eye worm)	hypothetical protein	0.0082	0.0587	0.1068
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.0017	0.0061	0.0111
Echinococcus granulosus	acetylcholinesterase	0.0485	0.3868	0.7042
Onchocerca volvulus		0.0017	0.0061	0.0359
Trichomonas vaginalis	conserved hypothetical protein	0.0034	0.0198	0.0841
Echinococcus multilocularis	receptor type tyrosine protein phosphatase zeta	0.0017	0.0061	0.0111
Loa Loa (eye worm)	hypothetical protein	0.0036	0.0214	0.0389
Onchocerca volvulus		0.0017	0.0061	0.0359
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0061	0.0111
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0017	0.0061	0.0111
Echinococcus multilocularis	ubiquitin carboxyl terminal hydrolase 8	0.0039	0.0239	0.0434
Echinococcus multilocularis	tyrosine protein phosphatase non receptor type	0.0017	0.0061	0.0111
Trichomonas vaginalis	D-aminoacylase, putative	0.0036	0.0214	0.0936
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0017	0.0061	0.0111
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.0017	0.0061	0.0111
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0017	0.0061	0.0111
Schistosoma mansoni	hypothetical protein	0.0309	0.2434	0.2434
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0017	0.0061	0.0111
Brugia malayi	Bloom's syndrome protein homolog	0.0019	0.0077	0.0141
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0017	0.0061	0.0111
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0017	0.0061	0.0111
Trypanosoma cruzi	apurinic/apyrimidinic endonuclease, putative	0.0018	0.0069	0.0037
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0036	0.0214	0.0389
Schistosoma mansoni	ap endonuclease	0.0018	0.0069	0.0069
Trypanosoma cruzi	importin beta-1 subunit, putative	0.0023	0.0111	0.0214
Echinococcus multilocularis	receptor type tyrosine protein phosphatase F	0.0017	0.0061	0.0111
Onchocerca volvulus		0.0017	0.0061	0.0359
Trichomonas vaginalis	conserved hypothetical protein	0.0034	0.0198	0.0841
Echinococcus multilocularis	para nitrobenzyl esterase	0.0082	0.0587	0.1068
Echinococcus multilocularis	snurportin 1	0.0309	0.2434	0.4432
Echinococcus multilocularis	hypothetical protein	0.0017	0.0061	0.0111
Trichomonas vaginalis	low molecular weight protein tyrosine phosphatase, putative	0.0056	0.0375	0.1925
Trypanosoma brucei	transcription factor BTF3, putative	0.0034	0.0198	0.059
Loa Loa (eye worm)	hypothetical protein	0.0485	0.3868	0.7042
Schistosoma mansoni	receptor tyrosine phosphatase type r2a	0.0017	0.0061	0.0061
Loa Loa (eye worm)	hypothetical protein	0.0039	0.0239	0.0434
Entamoeba histolytica	glycogenphosphorylase, putative	0.0094	0.0686	0.4054
Onchocerca volvulus		0.0017	0.0061	0.0359
Schistosoma mansoni	glycogen phosphorylase	0.0218	0.1693	0.1693
Brugia malayi	hypothetical protein	0.0017	0.0061	0.0111
Echinococcus multilocularis	receptor type tyrosine protein phosphatase zeta	0.0017	0.0061	0.0111
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0061	0.0111
Loa Loa (eye worm)	hypothetical protein	0.0017	0.0061	0.0111
Schistosoma mansoni	protein-tyrosine phosphatase non-receptor type nt5	0.0017	0.0061	0.0061
Schistosoma mansoni	pcd6 interacting protein-related	0.0017	0.0061	0.0061
Schistosoma mansoni	receptor protein tyrosine phosphatase n (ia2)	0.0017	0.0061	0.0061
Schistosoma mansoni	receptor tyrosine phosphatase type r2a	0.0017	0.0061	0.0061
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.0684	0.5492	1
Trichomonas vaginalis	low molecular weight protein tyrosine phosphatase, putative	0.0182	0.1397	0.8189
Brugia malayi	Importin beta-1 subunit	0.0029	0.0155	0.0282
Loa Loa (eye worm)	ICD-1 protein	0.0034	0.0198	0.0361
Mycobacterium ulcerans	carboxylesterase, LipT	0.0082	0.0587	0.2509
Mycobacterium ulcerans	lipase LipD	0.0036	0.0214	0.07
Echinococcus multilocularis	transcription factor btf3	0.0034	0.0198	0.0361
Trypanosoma brucei	ubiquitin carboxyl-terminal hydrolase, putative	0.0039	0.0239	0.0764
Entamoeba histolytica	glycogen phosphorylase, putative	0.0218	0.1693	1
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0017	0.0061	0.0111
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.0017	0.0061	0.0111
Trypanosoma cruzi	mitochondrial DNA polymerase beta-PAK, putative	0.0143	0.1087	0.4413
Echinococcus multilocularis	acetylcholinesterase	0.0485	0.3868	0.7042
Schistosoma mansoni	non-receptor protein-tyrosine phosphatase	0.0017	0.0061	0.0061
Toxoplasma gondii	ATP-dependent DNA helicase, RecQ family protein	0.0019	0.0077	0.2439
Schistosoma mansoni	rgs-gaip interacting protein gipc	0.0017	0.0061	0.0061
Loa Loa (eye worm)	hypothetical protein	0.0082	0.0587	0.1068
Onchocerca volvulus		0.0017	0.0061	0.0359

Activities

Activity type	Activity value	Assay description	Source	Reference
Ki (binding)	= 21 nM	Displacement of [3H]U69593 from human kappa opioid receptor expressed in CHO cells after 60 mins by scintillation counting	ChEMBL.	21351746
Ki (binding)	= 140 nM	Displacement of [3H]Naltrindole from human delta opioid receptor expressed in CHO cells after 3 hrs by scintillation counting	ChEMBL.	21351746
Ki (binding)	= 180 nM	Displacement of [3H]DAMGO from human mu opioid receptor expressed in CHO cells after 60 mins by scintillation counting	ChEMBL.	21351746

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: CHEMBL1766029

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 1524310