TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 360.401 | Formula: C19H22F2N4O
H donors: 0 H acceptors: 2 LogP: 3.15 Rotable bonds: 4
Rule of 5 violations (Lipinski): 1
SMILES: Fc1ccc(cc1)OC[C@H]1CC[C@@H]2N(C1)CCN(C2)c1ncc(cn1)F
InChi: 1S/C19H22F2N4O/c20-15-2-5-18(6-3-15)26-13-14-1-4-17-12-25(8-7-24(17)11-14)19-22-9-16(21)10-23-19/h2-3,5-6,9-10,14,17H,1,4,7-8,11-13H2/t14-,17-/m0/s1
InChiKey: QXWNESOGWFJDFR-YOEHRIQHSA-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	dopamine receptor D2	Starlite/ChEMBL	References
Homo sapiens	dopamine receptor D4	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

No druggable targets predicted by sequence similarity

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Echinococcus multilocularis	beta tubulin	0.0616	0.263	0.2305
Brugia malayi	Cell division protein ftsZ	0.0167	0.0422	0.0647
Echinococcus granulosus	Tubulin beta 2C chain	0.0616	0.263	0.2305
Trypanosoma brucei	beta tubulin	0.0385	0.1494	0.4855
Echinococcus granulosus	Tubulin beta 2C chain	0.0616	0.263	0.2305
Brugia malayi	Matrix metalloprotease, N-terminal domain containing protein	0.0708	0.3083	0.4732
Echinococcus multilocularis	tubulin, beta 4A class IVa	0.0616	0.263	0.2305
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.0422	0.1677	0.5682
Echinococcus multilocularis	tubulin gamma 1 chain	0.0385	0.1494	0.1119
Echinococcus granulosus	tubulin alpha chain	0.0589	0.2499	0.2169
Leishmania major	beta tubulin	0.0616	0.263	1
Trypanosoma brucei	beta tubulin	0.0616	0.263	1
Leishmania major	beta tubulin	0.0616	0.263	1
Trichomonas vaginalis	tubulin alpha chain, putative	0.0218	0.0671	0.113
Trypanosoma brucei	epsilon tubulin	0.0385	0.1494	0.4855
Brugia malayi	Matrixin family protein	0.0581	0.246	0.3775
Echinococcus multilocularis	tubulin alpha	0.0385	0.1494	0.1119
Echinococcus granulosus	Tubulin beta 2C chain	0.0616	0.263	0.2305
Echinococcus multilocularis	tubulin epsilon chain	0.0385	0.1494	0.1119
Loa Loa (eye worm)	tubulin beta chain	0.0167	0.0422	0.0498
Trypanosoma brucei	alpha tubulin	0.0589	0.2499	0.9408
Leishmania major	alpha tubulin	0.0589	0.2499	0.9408
Brugia malayi	Matrixin family protein	0.1405	0.6516	1
Loa Loa (eye worm)	tubulin alpha 2	0.0422	0.1677	0.2455
Plasmodium falciparum	tubulin gamma chain	0.0385	0.1494	0.4855
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0228	0.0724	0.1134
Echinococcus granulosus	Tubulin beta 2C chain	0.0616	0.263	0.2305
Loa Loa (eye worm)	hypothetical protein	0.0153	0.0352	0.039
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0149	0.0335	0.0514
Leishmania major	beta tubulin	0.0616	0.263	1
Leishmania major	beta tubulin	0.0616	0.263	1
Loa Loa (eye worm)	hypothetical protein	0.0581	0.246	0.3676
Brugia malayi	Tubulin beta chain	0.0218	0.0671	0.103
Schistosoma mansoni	tubulin subunit alpha	0.0589	0.2499	0.6747
Trypanosoma cruzi	epsilon tubulin, putative	0.0385	0.1494	0.4855
Echinococcus multilocularis	tubulin alpha chain	0.0589	0.2499	0.2169
Trichomonas vaginalis	tubulin beta chain, putative	0.0589	0.2499	0.9408
Brugia malayi	Tubulin beta-1 chain	0.0616	0.263	0.4036
Loa Loa (eye worm)	hypothetical protein	0.0178	0.0475	0.0581
Leishmania major	beta tubulin	0.0616	0.263	1
Schistosoma mansoni	glutaminase	0.0271	0.0936	0.2346
Leishmania major	beta tubulin	0.0616	0.263	1
Trypanosoma brucei	alpha tubulin	0.0589	0.2499	0.9408
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0149	0.0335	0.0363
Schistosoma mansoni	tubulin subunit alpha	0.0589	0.2499	0.6747
Entamoeba histolytica	tubulin family protein	0.0616	0.263	1
Echinococcus granulosus	tubulin alpha chain	0.0589	0.2499	0.2169
Loa Loa (eye worm)	tubulin alpha chain	0.0589	0.2499	0.3737
Loa Loa (eye worm)	hypothetical protein	0.0708	0.3083	0.4648
Leishmania major	alpha tubulin	0.0589	0.2499	0.9408
Trichomonas vaginalis	tubulin beta chain, putative	0.0589	0.2499	0.9408
Loa Loa (eye worm)	nucleolar RNA-associated protein alpha	0.0306	0.1104	0.1562
Echinococcus granulosus	snurportin 1	0.0306	0.1104	0.0712
Echinococcus granulosus	tubulin subunit TubB	0.0589	0.2499	0.2169
Echinococcus multilocularis	peroxisome assembly protein 26	0.0589	0.2499	0.2169
Leishmania major	beta tubulin	0.0616	0.263	1
Schistosoma mansoni	hypothetical protein	0.0172	0.0444	0.0961
Echinococcus multilocularis	geminin	0.0172	0.0444	0.0023
Trypanosoma cruzi	tubulin gamma chain	0.0385	0.1494	0.4855
Loa Loa (eye worm)	alpha-tubulin	0.0589	0.2499	0.3737
Echinococcus multilocularis	beta tubulin	0.0616	0.263	0.2305
Loa Loa (eye worm)	tubulin beta chain	0.0616	0.263	0.3941
Plasmodium falciparum	alpha tubulin 2	0.0589	0.2499	0.9408
Loa Loa (eye worm)	alpha-tubulin isotype 2	0.0422	0.1677	0.2455
Giardia lamblia	Gamma tubulin	0.0385	0.1494	0.4855
Echinococcus granulosus	tubulin beta 4A class IVa	0.0616	0.263	0.2305
Leishmania major	gamma-tubulin	0.0385	0.1494	0.4855
Trichomonas vaginalis	tubulin alpha chain, putative	0.0616	0.263	1
Brugia malayi	Hemopexin family protein	0.0824	0.3655	0.561
Echinococcus granulosus	Tubulin alpha 1 chain	0.0589	0.2499	0.2169
Echinococcus multilocularis	tubulin alpha 1C chain	0.0589	0.2499	0.2169
Plasmodium vivax	tubulin gamma chain, putative	0.0385	0.1494	0.4855
Echinococcus granulosus	tubulin alpha 1C chain	0.0589	0.2499	0.2169
Wolbachia endosymbiont of Brugia malayi	cell division protein FtsZ	0.0167	0.0422	0.5
Echinococcus multilocularis	Tubulin alpha 1 chain	0.0589	0.2499	0.2169
Toxoplasma gondii	beta-tubulin, putative	0.0616	0.263	1
Echinococcus granulosus	geminin	0.0172	0.0444	0.0023
Echinococcus granulosus	alpha tubulin	0.0589	0.2499	0.2169
Schistosoma mansoni	tubulin subunit beta	0.0616	0.263	0.7115
Mycobacterium leprae	PROBABLE HYDROLASE	0.0708	0.3083	1
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.0218	0.0671	0.113
Trichomonas vaginalis	tubulin beta chain, putative	0.0589	0.2499	0.9408
Plasmodium falciparum	tubulin epsilon chain, putative	0.0385	0.1494	0.4855
Loa Loa (eye worm)	matrix metalloproteinase	0.0581	0.246	0.3676
Plasmodium vivax	tubulin epsilon chain, putative	0.0385	0.1494	0.4855
Schistosoma mansoni	tubulin subunit alpha	0.0589	0.2499	0.6747
Trichomonas vaginalis	tubulin beta chain, putative	0.0218	0.0671	0.113
Leishmania major	alpha tubulin	0.0589	0.2499	0.9408
Trichomonas vaginalis	tubulin beta chain, putative	0.0616	0.263	1
Echinococcus granulosus	biogenic amine 5HT receptor	0.0178	0.0475	0.0055
Schistosoma mansoni	tubulin subunit alpha	0.0167	0.0422	0.09
Brugia malayi	alpha-tubulin	0.0589	0.2499	0.3836
Schistosoma mansoni	matrix metallopeptidase-7 (M10 family)	0.0581	0.246	0.6635
Loa Loa (eye worm)	alpha-tubulin	0.0589	0.2499	0.3737
Echinococcus multilocularis	tubulin alpha 1C chain	0.0589	0.2499	0.2169
Schistosoma mansoni	alpha tubulin	0.0589	0.2499	0.6747
Trypanosoma brucei	epsilon tubulin	0.0385	0.1494	0.4855
Echinococcus multilocularis	tubulin alpha chain	0.0589	0.2499	0.2169
Trypanosoma brucei	beta tubulin	0.0616	0.263	1
Loa Loa (eye worm)	hypothetical protein	0.0149	0.0335	0.0363
Echinococcus multilocularis	matrix metallopeptidase 7 (M10 family)	0.2113	1	1
Trichomonas vaginalis	tubulin, putative	0.0616	0.263	1
Schistosoma mansoni	alpha tubulin	0.0589	0.2499	0.6747
Leishmania major	beta tubulin	0.0616	0.263	1
Brugia malayi	tubulin alpha chain - mouse	0.0589	0.2499	0.3836
Onchocerca volvulus	Matrilysin homolog	0.0581	0.246	0.3769
Loa Loa (eye worm)	hypothetical protein	0.0581	0.246	0.3676
Trichomonas vaginalis	tubulin alpha chain, putative	0.0385	0.1494	0.4855
Onchocerca volvulus	Matrilysin homolog	0.1289	0.5944	1
Giardia lamblia	Beta tubulin	0.0616	0.263	1
Leishmania major	alpha tubulin	0.0589	0.2499	0.9408
Giardia lamblia	Beta tubulin	0.0616	0.263	1
Loa Loa (eye worm)	tubulin alpha 2	0.0422	0.1677	0.2455
Schistosoma mansoni	hypothetical protein	0.0824	0.3655	1
Leishmania major	alpha tubulin	0.0589	0.2499	0.9408
Brugia malayi	Tubulin gamma chain	0.0385	0.1494	0.2293
Loa Loa (eye worm)	matrixin family protein	0.1289	0.5944	0.9108
Loa Loa (eye worm)	beta-tubulin	0.0616	0.263	0.3941
Schistosoma mansoni	hypothetical protein	0.0306	0.1104	0.282
Leishmania major	beta tubulin	0.0616	0.263	1
Onchocerca volvulus		0.0824	0.3655	0.5907
Trypanosoma brucei	alpha tubulin	0.0589	0.2499	0.9408
Brugia malayi	latrophilin 2 splice variant baaae	0.0102	0.0102	0.0157
Echinococcus multilocularis	hypothetical protein	0.0589	0.2499	0.2169
Echinococcus granulosus	beta tubulin	0.0616	0.263	0.2305
Brugia malayi	beta-tubulin, identical	0.0616	0.263	0.4036
Loa Loa (eye worm)	transcription factor SMAD2	0.0119	0.0183	0.0126
Toxoplasma gondii	tubulin/FtsZ family, GTPase domain-containing protein	0.0385	0.1494	0.4855
Loa Loa (eye worm)	tubulin gamma chain	0.0385	0.1494	0.217
Echinococcus multilocularis	tubulin beta 1 chain	0.0616	0.263	0.2305
Onchocerca volvulus	Matrix metalloproteinase homolog	0.1289	0.5944	1
Brugia malayi	Tubulin beta chain	0.0167	0.0422	0.0647
Loa Loa (eye worm)	tubulin alpha-3 chain	0.0371	0.1427	0.2066
Giardia lamblia	Alpha-tubulin	0.0589	0.2499	0.9408
Leishmania major	beta tubulin	0.0616	0.263	1
Leishmania major	alpha tubulin	0.0589	0.2499	0.9408
Echinococcus multilocularis	Tubulin beta 2C chain	0.0616	0.263	0.2305
Echinococcus granulosus	tubulin subunit beta	0.0616	0.263	0.2305
Entamoeba histolytica	tubulin alpha chain, putative	0.0589	0.2499	0.8849
Schistosoma mansoni	tubulin subunit beta	0.0616	0.263	0.7115
Onchocerca volvulus		0.0218	0.0671	0.0571
Echinococcus multilocularis	atpase aaa+ type core atpase aaa type core	0.0805	0.3564	0.328
Echinococcus granulosus	tubulin alpha	0.0385	0.1494	0.1119
Echinococcus granulosus	tubulin alpha chain	0.0589	0.2499	0.2169
Leishmania major	alpha tubulin	0.0589	0.2499	0.9408
Loa Loa (eye worm)	BEN-1 protein	0.0616	0.263	0.3941
Leishmania major	beta tubulin	0.0616	0.263	1
Echinococcus granulosus	peroxisome assembly protein 26	0.0589	0.2499	0.2169
Echinococcus granulosus	tubulin alpha chain	0.0589	0.2499	0.2169
Treponema pallidum	cell division protein FtsZ	0.0167	0.0422	0.5
Loa Loa (eye worm)	tubulin beta-2A chain	0.0616	0.263	0.3941
Echinococcus granulosus	tubulin alpha 1C chain	0.0589	0.2499	0.2169
Brugia malayi	Tubulin alpha chain	0.0589	0.2499	0.3836
Leishmania major	epsilon tubulin, putative	0.0385	0.1494	0.4855
Leishmania major	alpha tubulin	0.0589	0.2499	0.9408
Echinococcus granulosus	Tubulin beta 2C chain	0.0616	0.263	0.2305
Trypanosoma brucei	beta tubulin	0.0616	0.263	1
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.0589	0.2499	0.9408
Echinococcus multilocularis	tubulin alpha chain	0.0589	0.2499	0.2169
Echinococcus multilocularis	tubulin alpha chain	0.0589	0.2499	0.2169
Trypanosoma brucei	alpha tubulin, putative	0.0218	0.0671	0.113
Schistosoma mansoni	alpha tubulin	0.0589	0.2499	0.6747
Schistosoma mansoni	tubulin subunit beta	0.0616	0.263	0.7115
Mycobacterium ulcerans	glutaminase	0.0271	0.0936	0.1931
Echinococcus multilocularis	serotonin receptor	0.0178	0.0475	0.0055
Schistosoma mansoni	tubulin subunit beta	0.0616	0.263	0.7115
Echinococcus granulosus	beta tubulin	0.0616	0.263	0.2305
Loa Loa (eye worm)	tubulin alpha chain	0.0589	0.2499	0.3737
Echinococcus granulosus	tubulin epsilon chain	0.0385	0.1494	0.1119
Schistosoma mansoni	tubulin subunit gamma	0.0385	0.1494	0.3917
Loa Loa (eye worm)	matrixin family protein	0.1405	0.6516	1
Plasmodium vivax	tubulin alpha chain, putative	0.0589	0.2499	0.9408
Schistosoma mansoni	tubulin subunit delta	0.0167	0.0422	0.09
Giardia lamblia	Beta tubulin	0.0616	0.263	1
Echinococcus multilocularis	tubulin subunit TubB	0.0589	0.2499	0.2169
Brugia malayi	hypothetical protein	0.0153	0.0352	0.054
Echinococcus granulosus	Tubulin alpha 1 chain	0.0589	0.2499	0.2169
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0149	0.0335	0.0514
Onchocerca volvulus		0.0581	0.246	0.3769
Echinococcus multilocularis	Tubulin beta 2C chain	0.0616	0.263	0.2305
Loa Loa (eye worm)	MH2 domain-containing protein	0.0119	0.0183	0.0126
Schistosoma mansoni	tubulin subunit epsilon	0.0385	0.1494	0.3917
Echinococcus multilocularis	Tubulin beta 2C chain	0.0616	0.263	0.2305
Loa Loa (eye worm)	tubulin alpha-2 chain	0.0589	0.2499	0.3737
Trichomonas vaginalis	glutaminase, putative	0.0271	0.0936	0.2327
Loa Loa (eye worm)	glutaminase 2	0.0271	0.0936	0.13
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0589	0.2499	0.9408
Loa Loa (eye worm)	hypothetical protein	0.0589	0.2499	0.3737
Toxoplasma gondii	beta-1 tubulin, putative	0.0616	0.263	1
Trichomonas vaginalis	tubulin gamma chain, putative	0.0385	0.1494	0.4855
Trypanosoma brucei	epsilon tubulin	0.0385	0.1494	0.4855
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.0371	0.1427	0.4552
Schistosoma mansoni	hypothetical protein	0.0172	0.0444	0.0961
Toxoplasma gondii	beta tubulin	0.0616	0.263	1
Echinococcus granulosus	tubulin beta 1 chain	0.0616	0.263	0.2305
Loa Loa (eye worm)	glutaminase	0.0271	0.0936	0.13
Trichomonas vaginalis	tubulin gamma chain, putative	0.0385	0.1494	0.4855
Echinococcus multilocularis	snurportin 1	0.0306	0.1104	0.0712
Loa Loa (eye worm)	hypothetical protein	0.0422	0.1677	0.2455
Trichomonas vaginalis	tubulin alpha chain, putative	0.0218	0.0671	0.113
Trypanosoma cruzi	beta tubulin, putative	0.0616	0.263	1
Echinococcus multilocularis	Tubulin alpha 1 chain	0.0589	0.2499	0.2169
Brugia malayi	glutaminase DH11.1	0.0271	0.0936	0.1436
Loa Loa (eye worm)	BEN-1 protein	0.0616	0.263	0.3941
Loa Loa (eye worm)	tubulin alpha 2	0.0204	0.0604	0.0783
Brugia malayi	Matrixin family protein	0.0581	0.246	0.3775
Echinococcus granulosus	tubulin gamma 1 chain	0.0385	0.1494	0.1119
Brugia malayi	Tubulin alpha-2 chain	0.0589	0.2499	0.3836
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0616	0.263	1
Trichomonas vaginalis	tubulin alpha chain, putative	0.0218	0.0671	0.113
Trichomonas vaginalis	tubulin gamma chain, putative	0.0616	0.263	1
Echinococcus multilocularis	tubulin alpha chain	0.0589	0.2499	0.2169
Plasmodium falciparum	tubulin beta chain	0.0616	0.263	1
Trypanosoma brucei	alpha tubulin	0.0589	0.2499	0.9408
Trypanosoma cruzi	alpha tubulin, putative	0.0589	0.2499	0.9408
Leishmania major	beta tubulin	0.0616	0.263	1
Echinococcus granulosus	tubulin alpha chain	0.0589	0.2499	0.2169
Echinococcus multilocularis	tubulin alpha 3 chain	0.0589	0.2499	0.2169
Echinococcus granulosus	tubulin alpha 3 chain	0.0589	0.2499	0.2169
Brugia malayi	Matrixin family protein	0.0581	0.246	0.3775
Brugia malayi	tubulin alpha-2 chain	0.0589	0.2499	0.3836
Echinococcus multilocularis	Tubulin beta 2C chain	0.0616	0.263	0.2305
Mycobacterium tuberculosis	Probable peptidoglycan hydrolase	0.0708	0.3083	1
Trichomonas vaginalis	tubulin beta chain, putative	0.0589	0.2499	0.9408
Loa Loa (eye worm)	tubulin beta-4 chain	0.0616	0.263	0.3941
Trichomonas vaginalis	tubulin beta chain, putative	0.0589	0.2499	0.9408
Trypanosoma brucei	beta tubulin	0.0616	0.263	1
Mycobacterium ulcerans	hydrolase	0.0708	0.3083	1
Leishmania major	beta tubulin	0.0616	0.263	1
Brugia malayi	Matrixin family protein	0.0581	0.246	0.3775
Brugia malayi	Tubulin alpha-2 chain	0.0589	0.2499	0.3836
Brugia malayi	Tubulin alpha chain	0.0167	0.0422	0.0647
Trypanosoma brucei	tubulin gamma chain	0.0385	0.1494	0.4855
Toxoplasma gondii	alpha tubulin TUBA1	0.0589	0.2499	0.9408
Brugia malayi	MH2 domain containing protein	0.0119	0.0183	0.0281
Leishmania major	beta tubulin	0.0616	0.263	1
Leishmania major	alpha tubulin	0.0589	0.2499	0.9408
Schistosoma mansoni	tubulin subunit beta	0.0616	0.263	0.7115
Trichomonas vaginalis	tubulin beta chain, putative	0.0589	0.2499	0.9408
Loa Loa (eye worm)	hypothetical protein	0.0178	0.0475	0.0581
Echinococcus multilocularis	serotonin receptor	0.0178	0.0475	0.0055
Giardia lamblia	Alpha-tubulin	0.0589	0.2499	0.9408
Trichomonas vaginalis	tubulin, putative	0.0218	0.0671	0.113
Toxoplasma gondii	alpha-tubulin I, putative	0.0589	0.2499	0.9408
Schistosoma mansoni	tubulin subunit beta	0.0616	0.263	0.7115
Echinococcus multilocularis	tubulin subunit beta	0.0616	0.263	0.2305
Echinococcus multilocularis	Tubulin beta 2C chain	0.0616	0.263	0.2305
Leishmania major	beta tubulin	0.0616	0.263	1
Echinococcus granulosus	Tubulin alpha 1 chain	0.0589	0.2499	0.2169
Plasmodium vivax	tubulin beta chain, putative	0.0616	0.263	1
Plasmodium falciparum	alpha tubulin 1	0.0589	0.2499	0.9408
Plasmodium vivax	tubulin alpha chain, putative	0.0589	0.2499	0.9408
Leishmania major	beta tubulin	0.0616	0.263	1
Schistosoma mansoni	tubulin subunit beta	0.0167	0.0422	0.09
Echinococcus granulosus	tubulin alpha 3 chain	0.0589	0.2499	0.2169
Leishmania major	beta tubulin	0.0616	0.263	1
Loa Loa (eye worm)	hypothetical protein	0.0371	0.1427	0.2066
Echinococcus multilocularis	tubulin alpha 3 chain	0.0589	0.2499	0.2169
Echinococcus multilocularis	Tubulin alpha 1 chain	0.0589	0.2499	0.2169
Entamoeba histolytica	tubulin family protein	0.0616	0.263	1
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0178	0.0475	0.1049
Entamoeba histolytica	tubulin alpha-1 chain	0.0589	0.2499	0.8849
Loa Loa (eye worm)	hypothetical protein	0.0581	0.246	0.3676
Leishmania major	beta tubulin	0.0616	0.263	1
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0589	0.2499	0.9408
Leishmania major	alpha tubulin	0.0589	0.2499	0.9408
Leishmania major	alpha tubulin	0.0589	0.2499	0.9408
Trichomonas vaginalis	tubulin, putative	0.0218	0.0671	0.113
Loa Loa (eye worm)	tubulin beta-1 chain	0.0616	0.263	0.3941
Trypanosoma cruzi	epsilon tubulin, putative	0.0385	0.1494	0.4855
Leishmania major	alpha tubulin	0.0589	0.2499	0.9408
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0616	0.263	1

Activities

Activity type	Activity value	Assay description	Source	Reference
Ki (binding)	= 2 nM	In vitro binding affinity at human D4 dopamine receptor in CHO cells by [3H]-spiperone displacment.	ChEMBL.	9871530
Ki (binding)	= 2 nM	In vitro binding affinity at human D4 dopamine receptor in CHO cells by [3H]-spiperone displacment.	ChEMBL.	9871530
Ki (binding)	= 68 nM	In vitro binding affinity against human D2 dopamine receptor in CHO cells by [3H]-spiperone displacement.	ChEMBL.	9871530
Ki (binding)	= 68 nM	In vitro binding affinity against human D2 dopamine receptor in CHO cells by [3H]-spiperone displacement.	ChEMBL.	9871530
Ratio (binding)	= 34	Ratio of affinity for D2 and D4 receptors	ChEMBL.	9871530

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: CHEMBL163009

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 278752