TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 435.938 | Formula: C23H28ClF2N3O
H donors: 1 H acceptors: 1 LogP: 4.69 Rotable bonds: 7
Rule of 5 violations (Lipinski): 1
SMILES: CC(=O)NCCCCN1CC[C@@H]2C(C1)c1cc(F)ccc1N2c1ccc(cc1)F.Cl
InChi: 1S/C23H27F2N3O.ClH/c1-16(29)26-11-2-3-12-27-13-10-23-21(15-27)20-14-18(25)6-9-22(20)28(23)19-7-4-17(24)5-8-19;/h4-9,14,21,23H,2-3,10-13,15H2,1H3,(H,26,29);1H/t21?,23-;/m1./s1
InChiKey: SCIISVFFAFWRKM-PZFASQSNSA-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
Rattus norvegicus	Dopamine receptor	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

No druggable targets predicted by orthology data

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Schistosoma japonicum	ko:K04136 adrenergic receptor, alpha 1b, putative	Dopamine receptor	475 aa	405 aa	33.3 %
Schistosoma japonicum	ko:K04135 adrenergic receptor, alpha 1a, putative	Dopamine receptor	475 aa	398 aa	34.2 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Brugia malayi	jmjC domain containing protein	0.0229	0.1205	0.1249
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.014	0.0582	0.2141
Echinococcus granulosus	Polycystic kidney disease protein	0.0098	0.0285	0.0278
Echinococcus multilocularis	cysteine protease	0.014	0.0582	0.0575
Loa Loa (eye worm)	jmjC domain-containing protein	0.0159	0.0713	0.0735
Trichomonas vaginalis	glucosylceramidase, putative	0.0291	0.1638	0.8131
Brugia malayi	hypothetical protein	0.0098	0.0285	0.029
Echinococcus multilocularis	cathepsin b	0.0431	0.2613	0.2608
Trichomonas vaginalis	glucosylceramidase, putative	0.0291	0.1638	0.8131
Brugia malayi	cathepsin L-like precursor	0.0103	0.0325	0.0331
Plasmodium falciparum	cysteine proteinase falcipain 2b	0.014	0.0582	1
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0086	0.0204	0.0197
Plasmodium vivax	multidomain scavenger receptor, putative	0.0098	0.0285	0.2144
Loa Loa (eye worm)	jmjC domain-containing protein	0.007	0.0094	0.0091
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.014	0.0582	0.2141
Leishmania major	cathepsin L-like protease	0.014	0.0582	0.0608
Echinococcus granulosus	lysine specific demethylase 5A	0.0159	0.0713	0.0706
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.014	0.0582	0.2141
Mycobacterium ulcerans	hypothetical protein	0.0186	0.0903	1
Echinococcus granulosus	tumor protein p63	0.0777	0.5032	0.5028
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.014	0.0582	0.2141
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.014	0.0582	0.2141
Trichomonas vaginalis	glucosylceramidase, putative	0.0191	0.0938	0.4159
Echinococcus multilocularis	RUN	0.0098	0.0285	0.0278
Loa Loa (eye worm)	doublecortin family protein	0.0098	0.0285	0.029
Onchocerca volvulus		0.014	0.0582	0.6176
Trypanosoma cruzi	mitochondrial DNA polymerase beta, putative	0.0354	0.2073	0.6028
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.014	0.0582	0.1173
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0103	0.0325	0.0681
Loa Loa (eye worm)	cytochrome P450 family protein	0.0114	0.0398	0.0407
Echinococcus granulosus	arachidonate 5 lipoxygenase	0.0585	0.3693	0.3688
Trypanosoma cruzi	cysteine proteinase, putative	0.0086	0.0204	0.0528
Trypanosoma cruzi	cysteine peptidase, putative	0.014	0.0582	0.1639
Trichomonas vaginalis	glucosylceramidase, putative	0.0191	0.0938	0.4159
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.014	0.0582	0.1173
Loa Loa (eye worm)	hypothetical protein	0.0188	0.0913	0.0945
Plasmodium falciparum	cysteine proteinase falcipain 2a	0.014	0.0582	1
Brugia malayi	cathepsin B-like cysteine proteinase	0.0431	0.2613	0.2716
Giardia lamblia	Cathepsin B precursor	0.0338	0.1968	0.5
Trypanosoma cruzi	cysteine proteinase, putative	0.0086	0.0204	0.0528
Loa Loa (eye worm)	fibroinase	0.014	0.0582	0.0599
Echinococcus granulosus	cathepsin L	0.0086	0.0204	0.0197
Loa Loa (eye worm)	hypothetical protein	0.0547	0.3423	0.3561
Trypanosoma brucei	cytochrome P450, putative	0.0114	0.0398	0.0602
Onchocerca volvulus		0.0103	0.0325	0.341
Loa Loa (eye worm)	MH2 domain-containing protein	0.0135	0.0543	0.0558
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.014	0.0582	0.2141
Leishmania major	cathepsin L-like protease	0.014	0.0582	0.0608
Trichomonas vaginalis	glucosylceramidase, putative	0.0191	0.0938	0.4159
Schistosoma mansoni	cathepsin F (C01 family)	0.014	0.0582	0.0575
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.143	0.96	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.014	0.0582	0.2141
Brugia malayi	Cathepsin L-like precursor	0.014	0.0582	0.0599
Echinococcus multilocularis	arachidonate 5 lipoxygenase	0.0585	0.3693	0.3688
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.014	0.0582	0.1173
Loa Loa (eye worm)	hypothetical protein	0.0098	0.0285	0.029
Echinococcus granulosus	lipoxygenase domain containing protein	0.0098	0.0285	0.0278
Echinococcus granulosus	cathepsin b	0.0431	0.2613	0.2608
Leishmania major	cathepsin L-like protease	0.014	0.0582	0.0608
Schistosoma mansoni	SmCB2 peptidase (C01 family)	0.0431	0.2613	0.2608
Trypanosoma cruzi	cysteine peptidase, putative	0.014	0.0582	0.1639
Trichomonas vaginalis	glucosylceramidase, putative	0.0191	0.0938	0.4159
Loa Loa (eye worm)	O-glycosyl hydrolase family 30 protein	0.0291	0.1638	0.17
Leishmania major	cysteine peptidase A (CPA)	0.014	0.0582	0.0608
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.014	0.0582	0.2141
Echinococcus multilocularis	Transcription factor, JmjC domain containing protein	0.0229	0.1205	0.1199
Entamoeba histolytica	cysteine protease, putative	0.014	0.0582	1
Trypanosoma cruzi	C-8 sterol isomerase, putative	0.0547	0.3423	1
Leishmania major	cathepsin L-like protease	0.014	0.0582	0.0608
Echinococcus multilocularis	cathepsin L cysteine protease	0.014	0.0582	0.0575
Echinococcus granulosus	cathepsin b	0.0431	0.2613	0.2608
Plasmodium falciparum	LCCL domain-containing protein	0.0098	0.0285	0.2144
Brugia malayi	Doublecortin family protein	0.0098	0.0285	0.029
Trypanosoma cruzi	mitochondrial DNA polymerase beta-PAK, putative	0.0167	0.0771	0.2196
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.014	0.0582	0.2141
Onchocerca volvulus		0.014	0.0582	0.6176
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.014	0.0582	0.2141
Trichomonas vaginalis	glucosylceramidase, putative	0.0291	0.1638	0.8131
Onchocerca volvulus		0.014	0.0582	0.6176
Loa Loa (eye worm)	hypothetical protein	0.0081	0.0169	0.0169
Loa Loa (eye worm)	transcription factor SMAD2	0.0135	0.0543	0.0558
Trichomonas vaginalis	glucosylceramidase, putative	0.0191	0.0938	0.4159
Schistosoma mansoni	lipoxygenase	0.0585	0.3693	0.3688
Leishmania major	cathepsin L-like protease	0.014	0.0582	0.0608
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.014	0.0582	0.1173
Trypanosoma brucei	cysteine peptidase C (CPC)	0.0338	0.1968	0.5478
Loa Loa (eye worm)	cathepsin B	0.0338	0.1968	0.2044
Schistosoma mansoni	rab6-interacting	0.0098	0.0285	0.0278
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.014	0.0582	0.2141
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0431	0.2613	0.2608
Schistosoma mansoni	hypothetical protein	0.0098	0.0285	0.0278
Entamoeba histolytica	cysteine proteinase, putative	0.0103	0.0325	0.3182
Brugia malayi	Cathepsin L-like precursor	0.014	0.0582	0.0599
Echinococcus granulosus	cathepsin l1	0.0103	0.0325	0.0318
Onchocerca volvulus		0.014	0.0582	0.6176
Trypanosoma brucei	C-8 sterol isomerase, putative	0.0547	0.3423	1
Loa Loa (eye worm)	hypothetical protein	0.014	0.0582	0.0599
Echinococcus granulosus	cathepsin L cysteine proteinase	0.014	0.0582	0.0575
Brugia malayi	Cytochrome P450 family protein	0.0114	0.0398	0.0407
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.014	0.0582	0.1173
Onchocerca volvulus		0.0114	0.0396	0.418
Echinococcus granulosus	Transcription factor JmjC domain containing protein	0.0229	0.1205	0.1199
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.014	0.0582	0.2141
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.014	0.0582	0.2141
Echinococcus multilocularis	cathepsin L	0.0086	0.0204	0.0197
Brugia malayi	hypothetical protein	0.0098	0.0285	0.029
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.014	0.0582	0.1173
Echinococcus multilocularis	lysine specific demethylase 5A	0.0159	0.0713	0.0706
Brugia malayi	Cathepsin L-like precursor	0.014	0.0582	0.0599
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.014	0.0582	0.2141
Leishmania major	C-8 sterol isomerase-like protein	0.0547	0.3423	1
Brugia malayi	Cathepsin L-like precursor	0.014	0.0582	0.0599
Brugia malayi	Cytochrome P450 family protein	0.0114	0.0398	0.0407
Brugia malayi	Papain family cysteine protease containing protein	0.0086	0.0204	0.0206
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0159	0.0713	0.0706
Trypanosoma cruzi	cysteine protease, putative	0.0086	0.0204	0.0528
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.014	0.0582	0.2141
Loa Loa (eye worm)	cytochrome P450 family protein	0.0114	0.0398	0.0407
Loa Loa (eye worm)	papain family cysteine protease containing protein	0.014	0.0582	0.0599
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0431	0.2613	0.2608
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.014	0.0582	0.1173
Entamoeba histolytica	cysteine proteinase, putative	0.014	0.0582	1
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.014	0.0582	0.1173
Loa Loa (eye worm)	hypothetical protein	0.0103	0.0325	0.0331
Leishmania major	cathepsin L-like protease	0.014	0.0582	0.0608
Onchocerca volvulus	Glucosylceramidase homolog	0.0191	0.0938	1
Loa Loa (eye worm)	hypothetical protein	0.0103	0.0325	0.0331
Trypanosoma cruzi	cysteine peptidase, clan CA, family C1, cathepsin L-like, putative	0.0103	0.0325	0.0882
Leishmania major	cathepsin L-like protease	0.014	0.0582	0.0608
Onchocerca volvulus		0.014	0.0582	0.6176
Trichomonas vaginalis	glucosylceramidase, putative	0.0291	0.1638	0.8131
Toxoplasma gondii	cathepsin B	0.0338	0.1968	1
Onchocerca volvulus		0.0098	0.0285	0.2989
Toxoplasma gondii	cathepsin CPL	0.014	0.0582	0.2957
Brugia malayi	Papain family cysteine protease containing protein	0.014	0.0582	0.0599
Leishmania major	mitochondrial DNA polymerase beta	0.0354	0.2073	0.5538
Echinococcus granulosus	cathepsin l cysteine peptidase	0.014	0.0582	0.0575
Trypanosoma cruzi	cysteine peptidase, putative	0.0086	0.0204	0.0528
Onchocerca volvulus		0.014	0.0582	0.6176
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.014	0.0582	0.0575
Trichomonas vaginalis	Clan CA, family C1, cathepsin L or K-like cysteine peptidase	0.014	0.0582	0.2141
Trichomonas vaginalis	glucosylceramidase, putative	0.0191	0.0938	0.4159
Echinococcus multilocularis	cathepsin b	0.0431	0.2613	0.2608
Onchocerca volvulus		0.0098	0.0285	0.2989
Echinococcus multilocularis	microtubule associated protein 2	0.1487	1	1
Brugia malayi	Papain family cysteine protease containing protein	0.0086	0.0204	0.0206
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0086	0.0204	0.0197
Echinococcus multilocularis	cathepsin l cysteine peptidase	0.014	0.0582	0.0575
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.014	0.0582	0.2141
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.014	0.0582	0.1173
Brugia malayi	Cathepsin L-like precursor	0.0103	0.0325	0.0331
Schistosoma mansoni	microtubule-associated protein tau	0.1487	1	1
Loa Loa (eye worm)	hypothetical protein	0.0114	0.0396	0.0406
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.014	0.0582	0.2141
Schistosoma mansoni	polycystin 1-related	0.0098	0.0285	0.0278
Trypanosoma cruzi	cytochrome P450, putative	0.0114	0.0398	0.1098
Loa Loa (eye worm)	hypothetical protein	0.0431	0.2613	0.2716
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0431	0.2613	0.2608
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.014	0.0582	0.2141
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.014	0.0582	0.1173
Echinococcus granulosus	cathepsin l1	0.014	0.0582	0.0575
Schistosoma mansoni	lipoxygenase	0.0409	0.2462	0.2456
Trichomonas vaginalis	glucosylceramidase, putative	0.0291	0.1638	0.8131
Trypanosoma brucei	cysteine peptidase, Clan CA, family C1, Cathepsin L-like	0.014	0.0582	0.1173
Onchocerca volvulus	Cathepsin L homolog	0.014	0.0582	0.6176
Trichomonas vaginalis	Clan CA, family C1, cathepsin B-like cysteine peptidase	0.0338	0.1968	1
Trypanosoma cruzi	cruzipain precursor, putative	0.014	0.0582	0.1639
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.0103	0.0325	0.0681
Loa Loa (eye worm)	ctsf protein	0.014	0.0582	0.0599
Brugia malayi	Cathepsin L-like precursor	0.014	0.0582	0.0599
Echinococcus multilocularis	tumor protein p63	0.0777	0.5032	0.5028
Brugia malayi	follicle stimulating hormone receptor	0.143	0.96	1
Brugia malayi	Cathepsin L-like precursor	0.014	0.0582	0.0599
Onchocerca volvulus	Cathepsin L homolog	0.014	0.0582	0.6176
Brugia malayi	Cathepsin L-like cysteine proteinase	0.0103	0.0325	0.0331
Schistosoma mansoni	cathepsin F (C01 family)	0.0103	0.0325	0.0318
Brugia malayi	MH2 domain containing protein	0.0135	0.0543	0.0558
Plasmodium vivax	vivapain-2	0.014	0.0582	1
Schistosoma mansoni	cathepsin F (C01 family)	0.014	0.0582	0.0575
Loa Loa (eye worm)	hypothetical protein	0.009	0.023	0.0232
Loa Loa (eye worm)	Papain cysteine protease/cathepsin propeptide inhibitor-containing protein	0.014	0.0582	0.0599
Schistosoma mansoni	jumonji domain containing protein	0.0206	0.1045	0.1038
Loa Loa (eye worm)	hypothetical protein	0.0103	0.0325	0.0331
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.0431	0.2613	0.7615
Echinococcus granulosus	cathepsin L cysteine protease	0.0086	0.0204	0.0197
Schistosoma mansoni	SmCL2-like peptidase (C01 family)	0.0086	0.0204	0.0197
Loa Loa (eye worm)	CYP4Cod1	0.0114	0.0398	0.0407
Loa Loa (eye worm)	hypothetical protein	0.0098	0.0285	0.029
Leishmania major	cathepsin L-like protease	0.014	0.0582	0.0608
Trypanosoma cruzi	cysteine peptidase, putative	0.014	0.0582	0.1639
Echinococcus granulosus	cysteine protease	0.0086	0.0204	0.0197
Echinococcus multilocularis	lipoxygenase domain containing protein	0.0098	0.0285	0.0278
Schistosoma mansoni	cellular tumor antigen P53	0.0114	0.0396	0.0389
Trichomonas vaginalis	glucosylceramidase, putative	0.0191	0.0938	0.4159
Echinococcus multilocularis	cathepsin L cysteine protease	0.014	0.0582	0.0575
Brugia malayi	O-Glycosyl hydrolase family 30 protein	0.0291	0.1638	0.17
Schistosoma mansoni	cathepsin B-like peptidase (C01 family)	0.0338	0.1968	0.1962
Trypanosoma brucei	mitochondrial DNA polymerase beta-PAK	0.0167	0.0771	0.1761
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.014	0.0582	0.2141
Brugia malayi	jmjC domain containing protein	0.0159	0.0713	0.0735
Trichomonas vaginalis	glucosylceramidase, putative	0.0201	0.101	0.4567
Giardia lamblia	Cathepsin B precursor	0.0338	0.1968	0.5
Brugia malayi	ERG2 and Sigma1 receptor like protein	0.0547	0.3423	0.3561
Entamoeba histolytica	cysteine proteinase, putative	0.014	0.0582	1
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.014	0.0582	0.2141
Loa Loa (eye worm)	cysteine protease	0.014	0.0582	0.0599
Echinococcus multilocularis	Polycystic kidney disease protein	0.0098	0.0285	0.0278
Giardia lamblia	Cathepsin B precursor	0.0338	0.1968	0.5
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.014	0.0582	0.2141
Trypanosoma cruzi	cysteine peptidase (N-terminal), putative	0.0086	0.0204	0.0528
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.014	0.0582	0.2141
Plasmodium falciparum	cysteine proteinase falcipain 3	0.014	0.0582	1
Leishmania major	mitochondrial DNA polymerase beta-PAK, putative	0.0167	0.0771	0.1234
Trypanosoma cruzi	mitochondrial DNA polymerase beta, putative	0.0354	0.2073	0.6028
Schistosoma mansoni	loxhd1	0.0098	0.0285	0.0278
Echinococcus granulosus	lipoxygenase domain containing protein	0.0098	0.0285	0.0278
Trypanosoma cruzi	cytochrome P450, putative	0.0114	0.0398	0.1098
Trypanosoma brucei	mitochondrial DNA polymerase beta	0.0354	0.2073	0.5806
Onchocerca volvulus	Cathepsin F homolog	0.014	0.0582	0.6176
Echinococcus granulosus	RUN	0.0098	0.0285	0.0278
Leishmania major	cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like	0.0338	0.1968	0.5189
Trichomonas vaginalis	glucosylceramidase, putative	0.0201	0.101	0.4567
Brugia malayi	Cathepsin L-like precursor	0.0103	0.0325	0.0331
Trypanosoma cruzi	cysteine peptidase C (CPC), putative	0.0338	0.1968	0.5717
Plasmodium vivax	vivapain-2	0.014	0.0582	1
Trichomonas vaginalis	glucosylceramidase, putative	0.0291	0.1638	0.8131
Schistosoma mansoni	jumonji/arid domain-containing protein	0.0159	0.0713	0.0706
Trichomonas vaginalis	Clan CA, family C1, cathepsin L-like cysteine peptidase	0.014	0.0582	0.2141
Onchocerca volvulus		0.014	0.0582	0.6176
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0186	0.0903	0.5
Echinococcus multilocularis	lipoxygenase domain containing protein	0.0098	0.0285	0.0278
Schistosoma mansoni	rab6-interacting	0.0098	0.0285	0.0278
Trypanosoma cruzi	cysteine peptidase, putative	0.014	0.0582	0.1639
Trichomonas vaginalis	Clan CA, family C1, papain-like cysteine peptidase	0.014	0.0582	0.2141
Echinococcus multilocularis	cysteine protease	0.014	0.0582	0.0575

Activities

Activity type	Activity value	Assay description	Source	Reference
ED50 (functional)	= 0.006 mg kg-1	Ability to antagonize the stereotypy in rats induced by d-amphetamine sulfate 5 h later of the treatment	ChEMBL.	2876105
ED50 (functional)	= 0.02 mg kg-1	Ability to antagonize the stereotypy in rats induced by d-amphetamine sulfate 1 h later of the treatment	ChEMBL.	2876105
ED50 (functional)	= 0.66 mg kg-1	Ability to antagonize the stereotypy in rats induced by d-amphetamine sulfate 24 h later of the treatment	ChEMBL.	2876105
IC50 (binding)	= 15 nM	Ability to displace [3H]-spiroperidol from labeled Dopamine receptor of corpus striatum	ChEMBL.	2876105

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.

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External resources for this compound

ChEMBL: CHEMBL542874

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1034304