TDR Targets

Basic information

Technical information

TDR Targets ID: 113781
Name: (2R)-3-[3-(4-chloro-3-ethylphenoxy)-N-[[3-(tr ifluoromethoxy)phenyl]methyl]anilino]-1,1,1-t rifluoropropan-2-ol
MW: 533.89 | Formula: C25H22ClF6NO3
H donors: 1 H acceptors: 1 LogP: 8.17 Rotable bonds: 11
Rule of 5 violations (Lipinski): 2
SMILES: CCc1cc(ccc1Cl)Oc1cccc(c1)N(C[C@H](C(F)(F)F)O)Cc1cccc(c1)OC(F)(F)F
InChi: 1S/C25H22ClF6NO3/c1-2-17-12-20(9-10-22(17)26)35-19-7-4-6-18(13-19)33(15-23(34)24(27,28)29)14-16-5-3-8-21(11-16)36-25(30,31)32/h3-13,23,34H,2,14-15H2,1H3/t23-/m1/s1
InChiKey: QHEHKANREXVIRF-HSZRJFAPSA-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

(2R)-3-[3-(4-chloro-3-ethyl-phenoxy)-N-[[3-(trifluoromethoxy)phenyl]methyl]anilino]-1,1,1-trifluoro-propan-2-ol
(2R)-3-[3-(4-chloro-3-ethylphenoxy)-N-[[3-(trifluoromethoxy)phenyl]methyl]anilino]-1,1,1-trifluoro-2-propanol
(2R)-3-[[3-(4-chloro-3-ethyl-phenoxy)phenyl]-[[3-(trifluoromethoxy)phenyl]methyl]amino]-1,1,1-trifluoro-propan-2-ol
(2R)-3-[3-(4-chloro-3-ethyl-phenoxy)-N-[3-(trifluoromethoxy)benzyl]anilino]-1,1,1-trifluoro-propan-2-ol
(2R)-3-[[3-(4-chloro-3-ethylphenoxy)phenyl]-[[3-(trifluoromethoxy)phenyl]methyl]amino]-1,1,1-trifluoropropan-2-ol
(2R)-3-[[3-(4-chloro-3-ethyl-phenoxy)phenyl]-[3-(trifluoromethoxy)benzyl]amino]-1,1,1-trifluoro-propan-2-ol

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Oryctolagus cuniculus	Cholesteryl ester transfer protein	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
Toxoplasma gondii	peptidase, T1 family protein	0.0085	0.0454	0.0454
Loa Loa (eye worm)	hypothetical protein	0.0041	0.005	0.005
Echinococcus granulosus	proteasome subunit beta type 7	0.0085	0.0454	0.0454
Echinococcus granulosus	gamma secretase subunit aph 1	0.0246	0.194	0.194
Entamoeba histolytica	proteasome subunit beta type 5 precursor, putative	0.1121	1	1
Brugia malayi	Trypsin family protein	0.0098	0.0582	0.0582
Toxoplasma gondii	proteasome subunit alpha type 5-2, putative	0.0085	0.0454	0.0454
Plasmodium falciparum	proteasome subunit alpha type-1, putative	0.0085	0.0454	0.0454
Trypanosoma cruzi	proteasome alpha 7 subunit, putative	0.0085	0.0454	0.0454
Plasmodium vivax	proteasome subunit beta type-4, putative	0.0085	0.0454	0.0454
Loa Loa (eye worm)	proteasome subunit alpha type 7-1	0.0085	0.0454	0.0454
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0098	0.0582	0.0582
Brugia malayi	proteasome subunit alpha type 6	0.0085	0.0454	0.0454
Trypanosoma cruzi	proteasome beta 3 subunit, putative	0.0085	0.0454	0.0454
Echinococcus multilocularis	proteasome subunit beta type 6	0.0085	0.0454	0.0454
Trypanosoma cruzi	proteasome alpha 2 subunit, putative	0.0085	0.0454	0.0454
Brugia malayi	Proteasome A-type and B-type family protein	0.0085	0.0454	0.0454
Leishmania major	20s proteasome beta 7 subunit, (putative)	0.0085	0.0454	0.0454
Trypanosoma brucei	proteasome subunit beta type-5, putative	0.1121	1	1
Schistosoma mansoni	proteasome subunit beta 3 (T01 family)	0.0085	0.0454	0.0454
Toxoplasma gondii	proteasome beta subunit	0.0085	0.0454	0.0454
Schistosoma mansoni	proteasome subunit alpha 7 (T01 family)	0.0085	0.0454	0.0454
Trypanosoma cruzi	proteasome beta 3 subunit, putative	0.0085	0.0454	0.0454
Schistosoma mansoni	subfamily S1A unassigned peptidase (S01 family)	0.0098	0.0582	0.0582
Echinococcus granulosus	proteasome prosome macropain subunit alpha	0.0085	0.0454	0.0454
Echinococcus multilocularis	proteasome subunit alpha type 2	0.0085	0.0454	0.0454
Onchocerca volvulus		0.0041	0.005	0.0856
Trypanosoma cruzi	Aph-1 protein, putative	0.0096	0.0558	0.0558
Plasmodium vivax	proteasome subunit alpha type-7, putative	0.0085	0.0454	0.0454
Loa Loa (eye worm)	proteasome subunit alpha type 3	0.0085	0.0454	0.0454
Brugia malayi	proteasome subunit alpha type 4	0.0085	0.0454	0.0454
Plasmodium falciparum	proteasome subunit alpha type-5, putative	0.0085	0.0454	0.0454
Onchocerca volvulus		0.0041	0.005	0.0856
Onchocerca volvulus		0.0041	0.005	0.0856
Plasmodium vivax	ATP-dependent protease subunit ClpQ, putative	0.0085	0.0454	0.0454
Trichomonas vaginalis	Family T1, proteasome beta subunit, threonine peptidase	0.1121	1	1
Trypanosoma cruzi	proteasome alpha 7 subunit, putative	0.0085	0.0454	0.0454
Schistosoma mansoni	proteasome subunit alpha 4 (T01 family)	0.0085	0.0454	0.0454
Loa Loa (eye worm)	LBP/BPI/CETP family domain-containing protein	0.0041	0.005	0.005
Plasmodium vivax	proteasome subunit alpha type-2, putative	0.0085	0.0454	0.0454
Brugia malayi	Proteasome subunit alpha type 1	0.0085	0.0454	0.0454
Plasmodium vivax	proteasome subunit beta type-6, putative	0.0085	0.0454	0.0454
Trypanosoma cruzi	proteasome subunit beta type-5, putative	0.1121	1	1
Echinococcus multilocularis	subfamily T1A non peptidase ue	0.0085	0.0454	0.0454
Loa Loa (eye worm)	proteasome A-type and B-type family protein	0.0085	0.0454	0.0454
Plasmodium vivax	proteasome subunit beta type-1, putative	0.0085	0.0454	0.0454
Trypanosoma cruzi	proteasome beta 2 subunit, putative	0.0085	0.0454	0.0454
Onchocerca volvulus		0.0041	0.005	0.0856
Echinococcus multilocularis	Proteasome subunit alpha type 7	0.0085	0.0454	0.0454
Leishmania major	proteasome beta 2 subunit, putative	0.0085	0.0454	0.0454
Schistosoma mansoni	proteasome subunit beta 1 (T01 family)	0.0085	0.0454	0.0454
Trypanosoma cruzi	proteasome beta-1 subunit, putative	0.0085	0.0454	0.0454
Toxoplasma gondii	proteasome subunit beta type, putative	0.1121	1	1
Toxoplasma gondii	20S proteasome subunit beta 7, putative	0.0085	0.0454	0.0454
Echinococcus multilocularis	Proteasome, subunit alpha beta	0.0085	0.0454	0.0454
Mycobacterium ulcerans	proteasome PrcB	0.1121	1	1
Giardia lamblia	Proteasome subunit beta type 5 precursor	0.1121	1	1
Plasmodium falciparum	proteasome subunit alpha type-7, putative	0.0085	0.0454	0.0454
Plasmodium vivax	proteasome subunit alpha type-4, putative	0.0085	0.0454	0.0454
Leishmania major	proteasome alpha 1 subunit, putative	0.0085	0.0454	0.0454
Leishmania major	proteasome alpha 2 subunit, putative	0.0085	0.0454	0.0454
Mycobacterium leprae	proteasome (beta subunit) PrcB	0.1121	1	1
Brugia malayi	proteasome subunit beta type 2	0.0085	0.0454	0.0454
Leishmania major	proteasome beta 2 subunit, putative	0.0085	0.0454	0.0454
Echinococcus multilocularis	20S proteasome subunit alpha 6	0.0085	0.0454	0.0454
Echinococcus granulosus	Proteasome subunit alpha type 7	0.0085	0.0454	0.0454
Toxoplasma gondii	proteasome subunit alpha2, protease of the acylase family and NTN hydrolase fold, putative	0.0085	0.0454	0.0454
Loa Loa (eye worm)	proteasome subunit beta type 2	0.0085	0.0454	0.0454
Leishmania major	proteasome beta 6 subunit, putative,20S proteasome beta 6 subunit, putative	0.0085	0.0454	0.0454
Leishmania major	proteasome alpha 3 subunit, putative	0.0085	0.0454	0.0454
Trypanosoma cruzi	proteasome alpha 3 subunit, putative	0.0085	0.0454	0.0454
Trypanosoma cruzi	proteasome alpha 7 subunit, putative	0.0085	0.0454	0.0454
Toxoplasma gondii	proteasome subunit alpha type, putative	0.0085	0.0454	0.0454
Plasmodium falciparum	proteasome subunit alpha type-6, putative	0.0085	0.0454	0.0454
Onchocerca volvulus	Notchless protein homolog	0.0085	0.0454	0.7793
Trypanosoma cruzi	proteasome alpha 2 subunit, putative	0.0085	0.0454	0.0454
Plasmodium falciparum	proteasome subunit beta type-7, putative	0.0085	0.0454	0.0454
Echinococcus granulosus	proteasome subunit beta t family	0.0085	0.0454	0.0454
Plasmodium vivax	proteasome subunit alpha type-3, putative	0.0085	0.0454	0.0454
Echinococcus multilocularis	proteasome (prosome macropain) subunit alpha	0.0085	0.0454	0.0454
Echinococcus granulosus	proteasome prosome macropain subunit beta	0.0085	0.0454	0.0454
Echinococcus granulosus	subfamily T1A non peptidase ue	0.0085	0.0454	0.0454
Leishmania major	proteasome beta 5 subunit, putative	0.1121	1	1
Echinococcus multilocularis	proteasome (prosome, macropain) subunit, beta	0.0085	0.0454	0.0454
Echinococcus multilocularis	Proteasome subunit alpha type 7	0.0085	0.0454	0.0454
Onchocerca volvulus		0.0041	0.005	0.0856
Echinococcus multilocularis	proteasome (prosome, macropain)	0.1121	1	1
Schistosoma mansoni	proteasome catalytic subunit 1 (T01 family)	0.0085	0.0454	0.0454
Trypanosoma brucei	Aph-1 protein, putative	0.0096	0.0558	0.0109
Echinococcus multilocularis	gamma secretase subunit aph 1	0.0246	0.194	0.194
Trypanosoma cruzi	20S proteasome subunit	0.0085	0.0454	0.0454
Loa Loa (eye worm)	PAS-3 protein	0.0085	0.0454	0.0454
Toxoplasma gondii	proteasome subunit alpha1, putative	0.0085	0.0454	0.0454
Echinococcus granulosus	proteasome subunit alpha type 6	0.0085	0.0454	0.0454
Leishmania major	hs1vu complex proteolytic subunit-like,hs1vu complex proteolytic subunit-like, threonine peptidase, Clan T(1), family T1B	0.0085	0.0454	0.0454
Onchocerca volvulus		0.0041	0.005	0.0856
Leishmania major	proteasome beta 3 subunit, putative	0.0085	0.0454	0.0454
Loa Loa (eye worm)	proteasome A-type and B-type family protein	0.1121	1	1
Toxoplasma gondii	proteasome subunit alpha type 1, putative	0.0085	0.0454	0.0454
Schistosoma mansoni	proteasome subunit alpha 2 (T01 family)	0.0085	0.0454	0.0454
Plasmodium vivax	proteasome subunit alpha type-1, putative	0.0085	0.0454	0.0454
Loa Loa (eye worm)	proteasome subunit beta type 1	0.0085	0.0454	0.0454
Schistosoma mansoni	proteasome subunit beta 2 (T01 family)	0.0085	0.0454	0.0454
Plasmodium vivax	proteasome subunit alpha type-5, putative	0.0085	0.0454	0.0454
Echinococcus granulosus	Proteasome subunit alpha beta	0.0085	0.0454	0.0454
Brugia malayi	Proteasome subunit alpha type 7-1	0.0085	0.0454	0.0454
Schistosoma mansoni	subfamily T1A non-peptidase homologue (T01 family)	0.0085	0.0454	0.0454
Loa Loa (eye worm)	proteasome subunit alpha type 1	0.0085	0.0454	0.0454
Brugia malayi	20S proteasome alpha5 subunit	0.0085	0.0454	0.0454
Echinococcus granulosus	proteasome prosome macropain subunit beta	0.0085	0.0454	0.0454
Leishmania major	proteasome alpha 7 subunit, putative	0.0085	0.0454	0.0454
Trypanosoma cruzi	proteasome beta 6 subunit, putative	0.0085	0.0454	0.0454
Plasmodium vivax	proteasome subunit alpha type-6, putative	0.0085	0.0454	0.0454
Onchocerca volvulus		0.0041	0.005	0.0856
Brugia malayi	Proteasome A-type and B-type family protein	0.0085	0.0454	0.0454
Loa Loa (eye worm)	proteasome subunit alpha type 6	0.0085	0.0454	0.0454
Plasmodium falciparum	ATP-dependent protease subunit ClpQ	0.0085	0.0454	0.0454
Trypanosoma cruzi	proteasome beta 7 subunit, putative	0.0085	0.0454	0.0454
Echinococcus granulosus	proteasome prosome macropain subunit beta type	0.0085	0.0454	0.0454
Leishmania major	20s proteasome beta 7 subunit, (putative)	0.0085	0.0454	0.0454
Leishmania major	20s proteasome beta 7 subunit, (putative)	0.0085	0.0454	0.0454
Leishmania major	20s proteasome beta 7 subunit, (putative)	0.0085	0.0454	0.0454
Leishmania major	20s proteasome beta 7 subunit, (putative)	0.0085	0.0454	0.0454
Toxoplasma gondii	heat shock protein hslv, putative	0.0085	0.0454	0.0454
Plasmodium falciparum	proteasome subunit beta type-4	0.0085	0.0454	0.0454
Brugia malayi	proteasome subunit alpha type 1	0.0085	0.0454	0.0454
Leishmania major	20s proteasome beta 7 subunit, (putative)	0.0085	0.0454	0.0454
Loa Loa (eye worm)	proteasome A-type and B-type family protein	0.0085	0.0454	0.0454
Plasmodium vivax	proteasome subunit beta type-5, putative	0.1121	1	1
Brugia malayi	LBP / BPI / CETP family, C-terminal domain containing protein	0.0041	0.005	0.005
Echinococcus granulosus	proteasome subunit beta type 6	0.0085	0.0454	0.0454
Plasmodium falciparum	proteasome subunit beta type-3, putative	0.0085	0.0454	0.0454
Loa Loa (eye worm)	proteasome subunit alpha type 2	0.0085	0.0454	0.0454
Onchocerca volvulus		0.0098	0.0582	1
Echinococcus granulosus	20S proteasome subunit alpha 6	0.0085	0.0454	0.0454
Trypanosoma cruzi	proteasome subunit alpha type-1, putative	0.0085	0.0454	0.0454
Leishmania major	proteasome alpha 1 subunit, putative	0.0085	0.0454	0.0454
Loa Loa (eye worm)	20S proteasome alpha5 subunit	0.0085	0.0454	0.0454
Trypanosoma cruzi	Aph-1 protein, putative	0.0096	0.0558	0.0558
Trypanosoma cruzi	proteasome subunit beta type-5, putative	0.1121	1	1
Onchocerca volvulus		0.0041	0.005	0.0856
Toxoplasma gondii	proteasome subunit beta type 7 precursor, putative	0.0085	0.0454	0.0454
Brugia malayi	LBP / BPI / CETP family, N-terminal domain containing protein	0.0041	0.005	0.005
Loa Loa (eye worm)	proteasome subunit beta type 3	0.0085	0.0454	0.0454
Leishmania major	proteasome alpha 7 subunit, putative	0.0085	0.0454	0.0454
Plasmodium vivax	proteasome subunit beta type-3, putative	0.0085	0.0454	0.0454
Plasmodium falciparum	proteasome subunit beta type-5	0.1121	1	1
Schistosoma mansoni	proteasome subunit beta 2 (T01 family)	0.0085	0.0454	0.0454
Echinococcus multilocularis	proteasome subunit beta type 7	0.0085	0.0454	0.0454
Schistosoma mansoni	proteasome catalytic subunit 2 (T01 family)	0.0085	0.0454	0.0454
Plasmodium falciparum	proteasome subunit alpha type-4, putative	0.0085	0.0454	0.0454
Plasmodium vivax	proteasome subunit beta type-2, putative	0.0085	0.0454	0.0454
Plasmodium vivax	proteasome subunit beta type-7, putative	0.0085	0.0454	0.0454
Loa Loa (eye worm)	gamma-secretase subunit aph-1	0.0246	0.194	0.194
Plasmodium falciparum	proteasome subunit beta type-1, putative	0.0085	0.0454	0.0454
Leishmania major	proteasome alpha 5 subunit, putative,20S proteasome subunit alpha 5, (putative)	0.0085	0.0454	0.0454
Loa Loa (eye worm)	hypothetical protein	0.0098	0.0582	0.0582
Echinococcus multilocularis	proteasome subunit alpha type 6	0.0085	0.0454	0.0454
Brugia malayi	LBP / BPI / CETP family, N-terminal domain containing protein	0.0041	0.005	0.005
Plasmodium falciparum	proteasome subunit alpha type-3, putative	0.0085	0.0454	0.0454
Brugia malayi	proteasome subunit alpha type 3	0.0085	0.0454	0.0454
Leishmania major	proteasome beta 7 subunit, putative	0.0085	0.0454	0.0454
Schistosoma mansoni	proteasome subunit alpha 3 (T01 family)	0.0085	0.0454	0.0454
Brugia malayi	proteasome subunit beta type 3	0.0085	0.0454	0.0454
Onchocerca volvulus		0.0085	0.046	0.7907
Trypanosoma cruzi	proteasome subunit beta type-2, putative	0.0085	0.0454	0.0454
Brugia malayi	gamma-secretase subunit aph-1	0.0246	0.194	0.194
Plasmodium falciparum	proteasome subunit alpha type-2, putative	0.0085	0.0454	0.0454
Trypanosoma cruzi	proteasome subunit alpha type-5, putative	0.0085	0.0454	0.0454
Schistosoma mansoni	proteasome subunit beta 3 (T01 family)	0.0085	0.0454	0.0454
Brugia malayi	proteasome subunit alpha type 2	0.0085	0.0454	0.0454
Trypanosoma cruzi	proteasome alpha 1 subunit, putative	0.0085	0.0454	0.0454
Schistosoma mansoni	subfamily T1A non-peptidase homologue (T01 family)	0.0085	0.0454	0.0454
Brugia malayi	proteasome subunit beta type 1	0.0085	0.0454	0.0454
Loa Loa (eye worm)	hypothetical protein	0.0098	0.0582	0.0582
Toxoplasma gondii	proteasome subunit beta type 2, putative	0.0085	0.0454	0.0454
Schistosoma mansoni	proteasome subunit beta 4 (T01 family)	0.0085	0.0454	0.0454
Toxoplasma gondii	proteasome subunit	0.0085	0.0454	0.0454
Trypanosoma cruzi	proteasome beta-1 subunit, putative	0.0085	0.0454	0.0454
Schistosoma mansoni	proteasome subunit alpha 6 (T01 family)	0.0085	0.0454	0.0454
Trypanosoma cruzi	proteasome alpha 3 subunit, putative	0.0085	0.0454	0.0454
Echinococcus multilocularis	Proteasome subunit alpha type 7	0.0085	0.0454	0.0454
Trypanosoma cruzi	proteasome alpha 7 subunit, putative	0.0085	0.0454	0.0454
Loa Loa (eye worm)	proteasome A-type and B-type family protein	0.0085	0.0454	0.0454
Echinococcus multilocularis	proteasome (prosome macropain) subunit beta type	0.0085	0.0454	0.0454
Trypanosoma cruzi	proteasome subunit alpha type-5, putative	0.0085	0.0454	0.0454
Echinococcus granulosus	proteasome subunit alpha type 2	0.0085	0.0454	0.0454
Plasmodium falciparum	proteasome subunit beta type-6, putative	0.0085	0.0454	0.0454
Echinococcus granulosus	proteasome prosome macropain	0.1121	1	1
Leishmania major	proteasome beta-1 subunit, putative	0.0085	0.0454	0.0454
Mycobacterium tuberculosis	Proteasome beta subunit PrcB; assembles with alpha subunit PrcA.	0.1121	1	1
Schistosoma mansoni	proteasome subunit beta 2 (T01 family)	0.0085	0.0454	0.0454
Plasmodium falciparum	proteasome subunit beta type-2, putative	0.0085	0.0454	0.0454
Schistosoma mansoni	proteasome catalytic subunit 3 (T01 family)	0.1121	1	1
Trypanosoma cruzi	proteasome alpha 1 subunit, putative	0.0085	0.0454	0.0454
Wolbachia endosymbiont of Brugia malayi	ATP-dependent protease peptidase subunit	0.0085	0.0454	0.5
Trypanosoma cruzi	ATP-dependent protease subunit HslV, putative	0.0085	0.0454	0.0454
Toxoplasma gondii	proteasome subunit beta type 1, putative	0.0085	0.0454	0.0454
Echinococcus multilocularis	proteasome (prosome, macropain) subunit, beta	0.0085	0.0454	0.0454
Schistosoma mansoni	proteasome subunit alpha 1 (T01 family)	0.0085	0.0454	0.0454
Echinococcus multilocularis	proteasome subunit beta (t family) proteasome (prosome macropain) subunit beta	0.0085	0.0454	0.0454
Schistosoma mansoni	gamma-secretase subunit aph-1	0.0246	0.194	0.194
Brugia malayi	Proteasome A-type and B-type family protein	0.0085	0.0454	0.0454
Trypanosoma cruzi	hslVU complex proteolytic subunit, threonine peptidase, Clan T(1), family T1B	0.0085	0.0454	0.0454
Trypanosoma cruzi	proteasome beta 6 subunit, putative	0.0085	0.0454	0.0454
Schistosoma mansoni	subfamily T1A non-peptidase homologue (T01 family)	0.0085	0.0454	0.0454

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 0.035 uM	Inhibition of CETP in rabbit serum after 1 hr by fluorescent cholesteryl esters transfer assay	ChEMBL.	20116902
IC50 (binding)	= 35 uM	Compound was tested in vitro for inhibitory activity against recombinant human cholesteryl ester transfer protein in buffer	ChEMBL.	12747787
IC50 (binding)	= 35 uM	Compound was tested in vitro for inhibitory activity against recombinant human cholesteryl ester transfer protein in buffer	ChEMBL.	12747787
IC50 (binding)	= 790 uM	Compound was tested in vitro for inhibitory activity against recombinant human cholesteryl ester transfer protein in human serum	ChEMBL.	12747787
IC50 (binding)	= 790 uM	Compound was tested in vitro for inhibitory activity against recombinant human cholesteryl ester transfer protein in human serum	ChEMBL.	12747787

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: CHEMBL308019
PubChem: 11555584

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 113781