TDR Targets

Basic information

Technical information

TDR Targets ID: 1409415
Name: tert-butyl 4-[4-(1,3-benzodioxol-5-ylmethylca rbamoyl)-2-(2,6-dimethylphenyl)pyrazol-3-yl]p iperidine-1-carboxylate
MW: 532.631 | Formula: C30H36N4O5
H donors: 1 H acceptors: 3 LogP: 4.67 Rotable bonds: 9
Rule of 5 violations (Lipinski): 2
SMILES: O=C(N1CCC(CC1)c1c(cnn1c1c(C)cccc1C)C(=O)NCc1ccc2c(c1)OCO2)OC(C)(C)C
InChi: 1S/C30H36N4O5/c1-19-7-6-8-20(2)26(19)34-27(22-11-13-33(14-12-22)29(36)39-30(3,4)5)23(17-32-34)28(35)31-16-21-9-10-24-25(15-21)38-18-37-24/h6-10,15,17,22H,11-14,16,18H2,1-5H3,(H,31,35)
InChiKey: IKGQZAFOOIOTHN-UHFFFAOYSA-N

Network

Hover on a compound node to display the structore

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

This is a work in progress. Come back soon to try this features!

Clustering layers

This is a work in progress. Come back soon to try this features!

Synonyms

4-[4-[(1,3-benzodioxol-5-ylmethylamino)-oxomethyl]-2-(2,6-dimethylphenyl)-3-pyrazolyl]-1-piperidinecarboxylic acid tert-butyl ester
4-[4-(1,3-benzodioxol-5-ylmethylcarbamoyl)-2-(2,6-dimethylphenyl)pyrazol-3-yl]piperidine-1-carboxylic acid tert-butyl ester
E955-1890
NCGC00127036-01

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	bromodomain adjacent to zinc finger domain, 2B	Starlite/ChEMBL	No references
Homo sapiens	nuclear factor, erythroid 2-like 2	Starlite/ChEMBL	No references
Equus caballus	Ferritin light chain	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Schistosoma japonicum	Conserved hypothetical protein	Get druggable targets OG5_131570	All targets in OG5_131570
Brugia malayi	Bromodomain containing protein	Get druggable targets OG5_131570	All targets in OG5_131570
Schistosoma japonicum	hypothetical protein	Get druggable targets OG5_131570	All targets in OG5_131570
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_131570	All targets in OG5_131570
Echinococcus granulosus	bromodomain adjacent to zinc finger domain	Get druggable targets OG5_131570	All targets in OG5_131570
Schistosoma japonicum	ko:K01549 ATP synthase [EC3.6.3.14], putative	Get druggable targets OG5_131570	All targets in OG5_131570
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_131570	All targets in OG5_131570
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_131570	All targets in OG5_131570
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_131570	All targets in OG5_131570
Schistosoma japonicum	Cleft lip and palate transmembrane protein 1-like protein, putative	Get druggable targets OG5_131570	All targets in OG5_131570
Schistosoma japonicum	expressed protein	Get druggable targets OG5_131570	All targets in OG5_131570
Echinococcus multilocularis	bromodomain adjacent to zinc finger domain	Get druggable targets OG5_131570	All targets in OG5_131570
Schistosoma mansoni	bromodomain containing protein	Get druggable targets OG5_131570	All targets in OG5_131570

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Schistosoma mansoni	apoferritin-2	Ferritin light chain	175 aa	142 aa	29.6 %
Echinococcus multilocularis	expressed protein	Ferritin light chain	175 aa	146 aa	30.1 %
Schistosoma mansoni	apoferritin-2	Ferritin light chain	175 aa	146 aa	28.8 %
Schistosoma mansoni	ferritin	Ferritin light chain	175 aa	171 aa	43.9 %
Schistosoma mansoni	ferritin	Ferritin light chain	175 aa	171 aa	44.4 %
Schistosoma japonicum	Ferritin, putative	Ferritin light chain	175 aa	144 aa	24.3 %
Echinococcus granulosus	expressed protein	Ferritin light chain	175 aa	146 aa	28.8 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Loa Loa (eye worm)	tubulin alpha 2	0.0081	0.0605	0.2083
Trypanosoma brucei	alpha tubulin	0.0106	0.0865	0.337
Echinococcus multilocularis	transient receptor potential gamma protein	0.0094	0.0737	0.0923
Plasmodium falciparum	alpha tubulin 2	0.0106	0.0865	0.2853
Schistosoma mansoni	tubulin subunit alpha	0.0025	0.0012	0.0042
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.0074	0.0526	0.2038
Trichomonas vaginalis	tubulin alpha chain, putative	0.0032	0.0091	0.0313
Leishmania major	alpha tubulin	0.0106	0.0865	0.337
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0292	0.0992
Leishmania major	beta tubulin	0.0057	0.0351	0.135
Loa Loa (eye worm)	nucleolar RNA-associated protein alpha	0.0298	0.2875	1
Loa Loa (eye worm)	tubulin beta-1 chain	0.0057	0.0351	0.1197
Schistosoma mansoni	tubulin subunit beta	0.0057	0.0351	0.1221
Schistosoma mansoni	hypothetical protein	0.0032	0.0083	0.029
Echinococcus granulosus	tubulin epsilon chain	0.0057	0.0351	0.1221
Brugia malayi	Transient-receptor-potential like protein	0.0035	0.0118	0.0154
Leishmania major	beta tubulin	0.0057	0.0351	0.135
Echinococcus granulosus	bromodomain adjacent to zinc finger domain	0.0072	0.0508	0.1767
Toxoplasma gondii	HEAT repeat-containing protein	0.0028	0.0045	0.0145
Trypanosoma cruzi	alpha tubulin, putative	0.0106	0.0865	0.337
Loa Loa (eye worm)	tubulin alpha 2	0.0081	0.0605	0.2083
Entamoeba histolytica	tubulin family protein	0.0057	0.0351	0.2546
Leishmania major	beta tubulin	0.0057	0.0351	0.135
Plasmodium vivax	tubulin alpha chain, putative	0.0106	0.0865	0.2853
Echinococcus multilocularis	bromodomain adjacent to zinc finger domain	0.0043	0.0207	0.026
Schistosoma mansoni	hypothetical protein	0.0043	0.0208	0.0722
Giardia lamblia	Beta tubulin	0.0057	0.0351	0.1335
Trichomonas vaginalis	glucosylceramidase, putative	0.0183	0.1675	0.6596
Trypanosoma brucei	beta tubulin	0.0057	0.0351	0.135
Echinococcus granulosus	tubulin alpha chain	0.0106	0.0865	0.3009
Echinococcus multilocularis	atpase aaa+ type core atpase aaa type core	0.0785	0.7977	1
Trichomonas vaginalis	tubulin alpha chain, putative	0.0032	0.0091	0.0313
Schistosoma mansoni	tubulin subunit alpha	0.0106	0.0865	0.3009
Leishmania major	beta tubulin	0.0057	0.0351	0.135
Trichomonas vaginalis	tubulin beta chain, putative	0.0032	0.0091	0.0313
Leishmania major	beta tubulin	0.0057	0.0351	0.135
Echinococcus granulosus	tubulin alpha chain	0.0106	0.0865	0.3009
Echinococcus multilocularis	tubulin alpha chain	0.0106	0.0865	0.1084
Loa Loa (eye worm)	PHD-finger family protein	0.0025	0.0013	0.0019
Giardia lamblia	Gamma tubulin	0.0057	0.0351	0.1335
Echinococcus multilocularis	beta tubulin	0.0057	0.0351	0.044
Echinococcus granulosus	GPCR family 2	0.0032	0.0083	0.029
Schistosoma mansoni	transient receptor potential channel	0.0062	0.0403	0.1403
Loa Loa (eye worm)	alpha-tubulin isotype 2	0.0081	0.0605	0.2083
Trichomonas vaginalis	glucosylceramidase, putative	0.0174	0.1577	0.6207
Trichomonas vaginalis	glucosylceramidase, putative	0.0174	0.1577	0.6207
Giardia lamblia	Beta tubulin	0.0057	0.0351	0.1335
Loa Loa (eye worm)	hypothetical protein	0.0094	0.0737	0.2543
Giardia lamblia	Alpha-tubulin	0.0106	0.0865	0.3359
Leishmania major	beta tubulin	0.0057	0.0351	0.135
Echinococcus multilocularis	tubulin alpha 3 chain	0.0106	0.0865	0.1084
Toxoplasma gondii	alpha-tubulin I, putative	0.0106	0.0865	0.337
Toxoplasma gondii	tubulin/FtsZ family, GTPase domain-containing protein	0.0057	0.0351	0.135
Brugia malayi	latrophilin 2 splice variant baaae	0.0068	0.0468	0.0639
Plasmodium vivax	beta-ketoacyl-acyl carrier protein synthase III precursor, putative	0.0311	0.3012	1
Mycobacterium tuberculosis	3-oxoacyl-[acyl-carrier-protein] synthase III FabH (beta-ketoacyl-ACP synthase III) (KAS III)	0.0311	0.3012	1
Mycobacterium leprae	cell division protein FtsZ	0.0025	0.0012	0.5
Echinococcus granulosus	beta tubulin	0.0057	0.0351	0.1221
Brugia malayi	Cell division protein ftsZ	0.0025	0.0012	0.0006
Leishmania major	beta tubulin	0.0057	0.0351	0.135
Echinococcus granulosus	peroxisome assembly protein 26	0.0106	0.0865	0.3009
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.009	0.0691	0.095
Trypanosoma brucei	beta tubulin	0.0057	0.0351	0.135
Trichomonas vaginalis	glucosylceramidase, putative	0.0174	0.1577	0.6207
Echinococcus granulosus	tubulin beta 1 chain	0.0057	0.0351	0.1221
Echinococcus multilocularis	Tubulin alpha 1 chain	0.0106	0.0865	0.1084
Plasmodium falciparum	tubulin gamma chain	0.0057	0.0351	0.1143
Loa Loa (eye worm)	tubulin alpha-2 chain	0.0106	0.0865	0.299
Plasmodium vivax	delta tubulin, putative	0.0025	0.0012	0.0015
Echinococcus granulosus	short transient receptor potential channel 6	0.0062	0.0403	0.1403
Trypanosoma brucei	zeta tubulin, putative	0.0025	0.0012	0.0017
Echinococcus multilocularis	Tubulin beta 2C chain	0.0057	0.0351	0.044
Echinococcus multilocularis	tubulin alpha	0.0057	0.0351	0.044
Leishmania major	beta tubulin	0.0057	0.0351	0.135
Schistosoma mansoni	transient receptor potential channel	0.0062	0.0403	0.1403
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.009	0.0691	0.2404
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0032	0.0083	0.0263
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0043	0.0208	0.0722
Trypanosoma brucei	tubulin gamma chain	0.0057	0.0351	0.135
Echinococcus granulosus	TRP transient receptor potential channel	0.0035	0.0118	0.0412
Trypanosoma brucei	beta tubulin	0.0057	0.0351	0.135
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.009	0.0691	0.2383
Brugia malayi	Bromodomain containing protein	0.0091	0.0702	0.0965
Leishmania major	alpha tubulin	0.0106	0.0865	0.337
Leishmania major	gamma-tubulin	0.0057	0.0351	0.135
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0032	0.0083	0.0105
Echinococcus granulosus	tubulin alpha	0.0057	0.0351	0.1221
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0118	0.0385
Schistosoma mansoni	tubulin subunit alpha	0.0106	0.0865	0.3009
Brugia malayi	Tubulin beta-1 chain	0.0057	0.0351	0.0477
Echinococcus granulosus	tubulin alpha chain	0.0106	0.0865	0.3009
Brugia malayi	RNA, U transporter 1	0.0079	0.0584	0.0801
Plasmodium vivax	importin-beta 2, putative	0.0028	0.0045	0.0123
Trichomonas vaginalis	glucosylceramidase, putative	0.0265	0.2533	1
Trypanosoma brucei	alpha tubulin	0.0106	0.0865	0.337
Echinococcus granulosus	Tubulin alpha 1 chain	0.0106	0.0865	0.3009
Echinococcus granulosus	transient receptor potential ion channel A	0.0091	0.0704	0.2449
Leishmania major	alpha tubulin	0.0106	0.0865	0.337
Loa Loa (eye worm)	tubulin gamma chain	0.0057	0.0351	0.1197
Loa Loa (eye worm)	BEN-1 protein	0.0057	0.0351	0.1197
Trypanosoma brucei	importin beta-1 subunit, putative	0.0028	0.0045	0.0145
Trichomonas vaginalis	glucosylceramidase, putative	0.0183	0.1675	0.6596
Trypanosoma brucei	epsilon tubulin	0.0057	0.0351	0.135
Echinococcus granulosus	tubulin gamma 1 chain	0.0057	0.0351	0.1221
Trichomonas vaginalis	tubulin, putative	0.0032	0.0091	0.0313
Mycobacterium ulcerans	flavin-containing monoamine oxidase AofH	0.0288	0.2774	0.9206
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0106	0.0865	0.3382
Onchocerca volvulus	Glucosylceramidase homolog	0.0174	0.1577	0.15
Schistosoma mansoni	tubulin subunit epsilon	0.0057	0.0351	0.1221
Leishmania major	beta tubulin	0.0057	0.0351	0.135
Plasmodium vivax	tubulin alpha chain, putative	0.0106	0.0865	0.2853
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0032	0.0083	0.0104
Loa Loa (eye worm)	alpha-tubulin	0.0106	0.0865	0.299
Brugia malayi	PHD-finger family protein	0.003	0.0068	0.0083
Schistosoma mansoni	tubulin subunit beta	0.0025	0.0012	0.0042
Echinococcus granulosus	tubulin beta 4A class IVa	0.0057	0.0351	0.1221
Loa Loa (eye worm)	hypothetical protein	0.0049	0.0268	0.0907
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.01	0.0799	0.2759
Echinococcus multilocularis	tubulin alpha 1C chain	0.0106	0.0865	0.1084
Echinococcus granulosus	importin subunit beta 1	0.0028	0.0045	0.0155
Trypanosoma brucei	alpha tubulin	0.0106	0.0865	0.337
Leishmania major	alpha tubulin	0.0106	0.0865	0.337
Echinococcus multilocularis	Tubulin alpha 1 chain	0.0106	0.0865	0.1084
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.009	0.0691	0.2404
Loa Loa (eye worm)	beta-tubulin	0.0057	0.0351	0.1197
Entamoeba histolytica	tubulin gamma chain	0.0057	0.0351	0.2546
Echinococcus granulosus	tubulin subunit TubB	0.0106	0.0865	0.3009
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0085	0.0271
Leishmania major	alpha tubulin	0.0106	0.0865	0.337
Plasmodium vivax	telomerase reverse transcriptase, putative	0.0267	0.2551	0.8466
Brugia malayi	Calcitonin receptor-like protein seb-1	0.01	0.0799	0.11
Echinococcus granulosus	tubulin alpha chain	0.0106	0.0865	0.3009
Leishmania major	delta tubulin, putative	0.0025	0.0012	0.0017
Echinococcus multilocularis	tubulin delta chain	0.0025	0.0012	0.0015
Echinococcus multilocularis	tubulin epsilon chain	0.0057	0.0351	0.044
Loa Loa (eye worm)	O-glycosyl hydrolase family 30 protein	0.0265	0.2533	0.881
Echinococcus granulosus	bromodomain adjacent to zinc finger domain	0.0043	0.0207	0.072
Echinococcus granulosus	tubulin alpha 1C chain	0.0106	0.0865	0.3009
Leishmania major	beta tubulin	0.0057	0.0351	0.135
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.0081	0.0605	0.2351
Trypanosoma brucei	beta tubulin	0.0057	0.0351	0.135
Schistosoma mansoni	tubulin subunit alpha	0.0106	0.0865	0.3009
Trypanosoma brucei	alpha tubulin	0.0106	0.0865	0.337
Brugia malayi	Tubulin gamma chain	0.0057	0.0351	0.0477
Treponema pallidum	cell division protein FtsZ	0.0025	0.0012	0.5
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.01	0.0799	0.11
Entamoeba histolytica	hypothetical protein	0.0043	0.0208	0.0466
Loa Loa (eye worm)	BEN-1 protein	0.0057	0.0351	0.1197
Loa Loa (eye worm)	tubulin alpha-3 chain	0.0074	0.0526	0.1808
Loa Loa (eye worm)	tubulin alpha chain	0.0106	0.0865	0.299
Schistosoma mansoni	hypothetical protein	0.0032	0.0083	0.029
Brugia malayi	tubulin alpha-2 chain	0.0106	0.0865	0.1192
Echinococcus granulosus	Tubulin beta 2C chain	0.0057	0.0351	0.1221
Loa Loa (eye worm)	tubulin beta chain	0.0057	0.0351	0.1197
Loa Loa (eye worm)	hypothetical protein	0.0081	0.0605	0.2083
Trichomonas vaginalis	tubulin beta chain, putative	0.0106	0.0865	0.3382
Echinococcus multilocularis	tubulin subunit beta	0.0057	0.0351	0.044
Trypanosoma cruzi	beta tubulin, putative	0.0057	0.0351	0.135
Echinococcus granulosus	beta tubulin	0.0057	0.0351	0.1221
Trichomonas vaginalis	glucosylceramidase, putative	0.0174	0.1577	0.6207
Trichomonas vaginalis	tubulin alpha chain, putative	0.0057	0.0351	0.1344
Leishmania major	alpha tubulin	0.0106	0.0865	0.337
Leishmania major	beta tubulin	0.0057	0.0351	0.135
Echinococcus multilocularis	tubulin beta 1 chain	0.0057	0.0351	0.044
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.009	0.0691	0.2404
Schistosoma mansoni	transient receptor potential channel 4	0.0094	0.0737	0.2563
Brugia malayi	Latrophilin receptor protein 2	0.0032	0.0083	0.0105
Entamoeba histolytica	tubulin family protein	0.0057	0.0351	0.2546
Leishmania major	beta tubulin	0.0057	0.0351	0.135
Echinococcus granulosus	Tubulin beta 2C chain	0.0057	0.0351	0.1221
Trypanosoma cruzi	telomerase reverse transcriptase, putative	0.0267	0.2551	1
Echinococcus multilocularis	tubulin alpha chain	0.0106	0.0865	0.1084
Schistosoma mansoni	transcription factor LCR-F1	0.0043	0.0208	0.0722
Trichomonas vaginalis	tubulin beta chain, putative	0.0106	0.0865	0.3382
Toxoplasma gondii	beta tubulin	0.0057	0.0351	0.135
Echinococcus multilocularis	Tubulin beta 2C chain	0.0057	0.0351	0.044
Loa Loa (eye worm)	hypothetical protein	0.0074	0.0526	0.1808
Toxoplasma gondii	tubulin/FtsZ family, GTPase domain-containing protein	0.0025	0.0012	0.0017
Brugia malayi	Tubulin alpha chain	0.0106	0.0865	0.1192
Trypanosoma brucei	zeta tubulin	0.0025	0.0012	0.0017
Entamoeba histolytica	tubulin alpha chain, putative	0.0106	0.0865	1
Loa Loa (eye worm)	hypothetical protein	0.0059	0.0371	0.1265
Leishmania major	alpha tubulin	0.0106	0.0865	0.337
Trichomonas vaginalis	tubulin gamma chain, putative	0.0057	0.0351	0.1344
Trypanosoma cruzi	telomerase reverse transcriptase, putative	0.0267	0.2551	1
Trichomonas vaginalis	glucosylceramidase, putative	0.0265	0.2533	1
Mycobacterium ulcerans	beta-ketoacyl synthase-like protein	0.0311	0.3012	1
Plasmodium vivax	tubulin beta chain, putative	0.0057	0.0351	0.1143
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.0032	0.0091	0.0313
Trichomonas vaginalis	tubulin, putative	0.0057	0.0351	0.1344
Schistosoma mansoni	transient receptor potential channel	0.0094	0.0737	0.2563
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0057	0.0351	0.1344
Plasmodium vivax	tubulin gamma chain, putative	0.0057	0.0351	0.1143
Schistosoma mansoni	tubulin subunit beta	0.0057	0.0351	0.1221
Plasmodium falciparum	beta-ketoacyl-ACP synthase III	0.0311	0.3012	1
Echinococcus granulosus	fetal alzheimer antigen falz	0.0027	0.0038	0.0131
Schistosoma mansoni	bromodomain containing protein	0.0076	0.0553	0.1925
Echinococcus multilocularis	Tubulin beta 2C chain	0.0057	0.0351	0.044
Brugia malayi	alpha-tubulin	0.0106	0.0865	0.1192
Echinococcus granulosus	tubulin alpha 1C chain	0.0106	0.0865	0.3009
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0106	0.0865	0.3382
Echinococcus multilocularis	beta tubulin	0.0057	0.0351	0.044
Brugia malayi	Tubulin alpha-2 chain	0.0106	0.0865	0.1192
Plasmodium falciparum	alpha tubulin 1	0.0106	0.0865	0.2853
Brugia malayi	tubulin alpha chain - mouse	0.0106	0.0865	0.1192
Brugia malayi	Tubulin beta chain	0.0025	0.0012	0.0006
Trichomonas vaginalis	glucosylceramidase, putative	0.0265	0.2533	1
Leishmania major	beta tubulin	0.0057	0.0351	0.135
Plasmodium falciparum	tubulin epsilon chain, putative	0.0057	0.0351	0.1143
Echinococcus multilocularis	fetal alzheimer antigen, falz	0.0027	0.0038	0.0047
Echinococcus granulosus	Tubulin beta 2C chain	0.0057	0.0351	0.1221
Trichomonas vaginalis	tubulin beta chain, putative	0.0106	0.0865	0.3382
Entamoeba histolytica	hypothetical protein	0.0043	0.0208	0.0466
Trypanosoma brucei	beta tubulin	0.0057	0.0351	0.135
Schistosoma mansoni	alpha tubulin	0.0106	0.0865	0.3009
Trichomonas vaginalis	glucosylceramidase, putative	0.0265	0.2533	1
Echinococcus granulosus	short transient receptor potential channel 6	0.0062	0.0403	0.1403
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.009	0.0691	0.2404
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0043	0.0208	0.026
Echinococcus multilocularis	tubulin subunit TubB	0.0106	0.0865	0.1084
Echinococcus granulosus	tubulin subunit beta	0.0057	0.0351	0.1221
Echinococcus multilocularis	GPCR, family 2	0.0032	0.0083	0.0104
Trichomonas vaginalis	tubulin beta chain, putative	0.0106	0.0865	0.3382
Echinococcus granulosus	tubulin alpha 3 chain	0.0106	0.0865	0.3009
Plasmodium falciparum	tubulin delta chain, putative	0.0025	0.0012	0.0015
Leishmania major	alpha tubulin	0.0106	0.0865	0.337
Trichomonas vaginalis	tubulin beta chain, putative	0.0106	0.0865	0.3382
Schistosoma mansoni	hypothetical protein	0.0025	0.0013	0.0047
Brugia malayi	Telomerase reverse transcriptase	0.071	0.7201	1
Brugia malayi	Tubulin beta chain	0.0032	0.0091	0.0116
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.009	0.0691	0.0866
Trichomonas vaginalis	tubulin beta chain, putative	0.0106	0.0865	0.3382
Mycobacterium ulcerans	3-oxoacyl-ACP synthase	0.0311	0.3012	1
Trypanosoma brucei	epsilon tubulin	0.0057	0.0351	0.135
Trypanosoma brucei	epsilon tubulin	0.0057	0.0351	0.135
Loa Loa (eye worm)	hypothetical protein	0.0068	0.0468	0.1604
Leishmania major	alpha tubulin	0.0106	0.0865	0.337
Echinococcus granulosus	snurportin 1	0.0298	0.2875	1
Trichomonas vaginalis	tubulin gamma chain, putative	0.0057	0.0351	0.1344
Loa Loa (eye worm)	hypothetical protein	0.01	0.0799	0.2759
Trichomonas vaginalis	tubulin alpha chain, putative	0.0032	0.0091	0.0313
Echinococcus multilocularis	Tubulin alpha 1 chain	0.0106	0.0865	0.1084
Loa Loa (eye worm)	alpha-tubulin	0.0106	0.0865	0.299
Echinococcus multilocularis	TRP (transient receptor potential) channel	0.0035	0.0118	0.0148
Schistosoma mansoni	acetyl-CoA C-acetyltransferase	0.0027	0.0038	0.0131
Trichomonas vaginalis	glucosylceramidase, putative	0.0174	0.1577	0.6207
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0045	0.0128
Schistosoma mansoni	tubulin subunit gamma	0.0057	0.0351	0.1221
Echinococcus multilocularis	importin subunit beta 1	0.0028	0.0045	0.0056
Loa Loa (eye worm)	tubulin beta chain	0.0025	0.0012	0.0015
Leishmania major	zeta tubulin, putative	0.0025	0.0012	0.0017
Schistosoma mansoni	hypothetical protein	0.0032	0.0083	0.029
Plasmodium vivax	tubulin epsilon chain, putative	0.0057	0.0351	0.1143
Leishmania major	telomerase reverse transcriptase, putative	0.0267	0.2551	1
Schistosoma mansoni	alpha tubulin	0.0106	0.0865	0.3009
Echinococcus multilocularis	snurportin 1	0.0298	0.2875	0.3603
Brugia malayi	Tubulin alpha-2 chain	0.0106	0.0865	0.1192
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0032	0.0083	0.0104
Trichomonas vaginalis	glucosylceramidase, putative	0.0265	0.2533	1
Echinococcus granulosus	alpha tubulin	0.0106	0.0865	0.3009
Schistosoma mansoni	hypothetical protein	0.0068	0.0468	0.1627
Echinococcus multilocularis	Tubulin beta 2C chain	0.0057	0.0351	0.044
Loa Loa (eye worm)	hypothetical protein	0.0085	0.0648	0.2231
Toxoplasma gondii	tubulin/FtsZ family, GTPase domain-containing protein	0.0025	0.0012	0.0017
Brugia malayi	O-Glycosyl hydrolase family 30 protein	0.0265	0.2533	0.3511
Wolbachia endosymbiont of Brugia malayi	3-oxoacyl-ACP synthase	0.0311	0.3012	1
Leishmania major	beta tubulin	0.0057	0.0351	0.135
Echinococcus granulosus	Tubulin beta 2C chain	0.0057	0.0351	0.1221
Brugia malayi	Bromodomain containing protein	0.0046	0.0237	0.0319
Echinococcus multilocularis	tubulin alpha chain	0.0106	0.0865	0.1084
Echinococcus multilocularis	tubulin alpha chain	0.0106	0.0865	0.1084
Entamoeba histolytica	hypothetical protein	0.0043	0.0208	0.0466
Echinococcus multilocularis	hypothetical protein	0.0106	0.0865	0.1084
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.009	0.0691	0.2404
Echinococcus multilocularis	peroxisome assembly protein 26	0.0106	0.0865	0.1084
Schistosoma mansoni	tubulin subunit beta	0.0057	0.0351	0.1221
Echinococcus multilocularis	short transient receptor potential channel 6	0.0062	0.0403	0.0506
Trypanosoma brucei	tubulin delta chain	0.0025	0.0012	0.0017
Loa Loa (eye worm)	tubulin beta-2A chain	0.0057	0.0351	0.1197
Schistosoma mansoni	hypothetical protein	0.0298	0.2875	1
Echinococcus multilocularis	tubulin alpha chain	0.0106	0.0865	0.1084
Trichomonas vaginalis	tubulin alpha chain, putative	0.0057	0.0351	0.1344
Leishmania major	alpha tubulin	0.0106	0.0865	0.337
Trypanosoma brucei	alpha tubulin, putative	0.0032	0.0091	0.0327
Loa Loa (eye worm)	tubulin beta-4 chain	0.0057	0.0351	0.1197
Entamoeba histolytica	hypothetical protein	0.0043	0.0208	0.0466
Leishmania major	epsilon tubulin, putative	0.0057	0.0351	0.135
Schistosoma mansoni	importin beta-1	0.0028	0.0045	0.0155
Trypanosoma cruzi	zeta tubulin, putative	0.0025	0.0012	0.0017
Leishmania major	alpha tubulin	0.0106	0.0865	0.337
Schistosoma mansoni	tubulin subunit beta	0.0057	0.0351	0.1221
Trichomonas vaginalis	tubulin alpha-1 chain, putative	0.0106	0.0865	0.3382
Brugia malayi	Tubulin alpha chain	0.0025	0.0012	0.0006
Leishmania major	beta tubulin	0.0057	0.0351	0.135
Echinococcus granulosus	transient receptor potential gamma protein	0.0094	0.0737	0.2563
Plasmodium falciparum	tubulin beta chain	0.0057	0.0351	0.1143
Giardia lamblia	Telomerase catalytic subunit	0.0267	0.2551	1
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0032	0.0083	0.029
Schistosoma mansoni	tubulin subunit beta	0.0057	0.0351	0.1221
Trypanosoma brucei	importin beta-1 subunit, putative	0.0028	0.0045	0.0145
Trypanosoma cruzi	epsilon tubulin, putative	0.0057	0.0351	0.135
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.009	0.0691	0.0866
Entamoeba histolytica	tubulin alpha-1 chain	0.0106	0.0865	1
Leishmania major	alpha tubulin	0.0106	0.0865	0.337
Toxoplasma gondii	RNA-directed DNA polymerase	0.0267	0.2551	1
Echinococcus granulosus	Tubulin beta 2C chain	0.0057	0.0351	0.1221
Trichomonas vaginalis	glucosylceramidase, putative	0.0265	0.2533	1
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0032	0.0083	0.029
Brugia malayi	Importin beta-1 subunit	0.0028	0.0045	0.0051
Trichomonas vaginalis	tubulin gamma chain, putative	0.0057	0.0351	0.1344
Mycobacterium tuberculosis	Probable flavin-containing monoamine oxidase AofH (amine oxidase) (MAO)	0.0268	0.2561	0.8497
Trichomonas vaginalis	tubulin epsilon chain, putative	0.0057	0.0351	0.1344
Schistosoma mansoni	hypothetical protein	0.0032	0.0083	0.029
Echinococcus multilocularis	tubulin alpha 3 chain	0.0106	0.0865	0.1084
Toxoplasma gondii	beta-tubulin, putative	0.0057	0.0351	0.135
Plasmodium falciparum	importin beta, putative	0.0028	0.0045	0.0123
Trichomonas vaginalis	glucosylceramidase, putative	0.0174	0.1577	0.6207
Echinococcus granulosus	tubulin alpha 3 chain	0.0106	0.0865	0.3009
Giardia lamblia	Beta tubulin	0.0057	0.0351	0.1335
Echinococcus multilocularis	Tubulin beta 2C chain	0.0057	0.0351	0.044
Echinococcus multilocularis	bromodomain adjacent to zinc finger domain	0.0072	0.0508	0.0637
Echinococcus multilocularis	short transient receptor potential channel 6	0.0062	0.0403	0.0506
Trichomonas vaginalis	tubulin beta chain, putative	0.0057	0.0351	0.1344
Trypanosoma cruzi	tubulin delta chain	0.0025	0.0012	0.0017
Leishmania major	beta tubulin	0.0057	0.0351	0.135
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0083	0.0263
Echinococcus granulosus	tubulin alpha chain	0.0106	0.0865	0.3009
Trypanosoma cruzi	zeta tubulin, putative	0.0025	0.0012	0.0017
Brugia malayi	beta-tubulin, identical	0.0057	0.0351	0.0477
Brugia malayi	hypothetical protein	0.0043	0.0208	0.0278
Schistosoma mansoni	alpha tubulin	0.0106	0.0865	0.3009
Trypanosoma brucei	telomerase reverse transcriptase	0.0267	0.2551	1
Trypanosoma cruzi	tubulin delta chain	0.0025	0.0012	0.0017
Echinococcus multilocularis	tubulin gamma 1 chain	0.0057	0.0351	0.044
Trypanosoma cruzi	epsilon tubulin, putative	0.0057	0.0351	0.135
Trichomonas vaginalis	tubulin, putative	0.0032	0.0091	0.0313
Toxoplasma gondii	beta-1 tubulin, putative	0.0057	0.0351	0.135
Schistosoma mansoni	tubulin subunit beta	0.0057	0.0351	0.1221
Schistosoma mansoni	tubulin subunit delta	0.0025	0.0012	0.0042
Echinococcus granulosus	tubulin delta chain	0.0025	0.0012	0.0042
Loa Loa (eye worm)	hypothetical protein	0.0106	0.0865	0.299
Loa Loa (eye worm)	tubulin alpha chain	0.0106	0.0865	0.299
Echinococcus granulosus	Tubulin alpha 1 chain	0.0106	0.0865	0.3009
Trichomonas vaginalis	glucosylceramidase, putative	0.0174	0.1577	0.6207
Plasmodium falciparum	telomerase reverse transcriptase	0.0267	0.2551	0.8466
Leishmania major	beta tubulin	0.0057	0.0351	0.135
Echinococcus multilocularis	tubulin, beta 4A class IVa	0.0057	0.0351	0.044
Echinococcus multilocularis	tubulin alpha 1C chain	0.0106	0.0865	0.1084
Trypanosoma cruzi	tubulin gamma chain	0.0057	0.0351	0.135
Echinococcus multilocularis	transient receptor potential ion channel A	0.0091	0.0704	0.0882
Loa Loa (eye worm)	hypothetical protein	0.0046	0.0238	0.0803
Giardia lamblia	Alpha-tubulin	0.0106	0.0865	0.3359
Echinococcus granulosus	Tubulin alpha 1 chain	0.0106	0.0865	0.3009
Mycobacterium ulcerans	3-oxoacyl-ACP synthase	0.0311	0.3012	1
Toxoplasma gondii	alpha tubulin TUBA1	0.0106	0.0865	0.337
Mycobacterium ulcerans	flavin-containing monoamine oxidase AofH	0.0288	0.2774	0.9206
Loa Loa (eye worm)	tubulin alpha 2	0.0049	0.0266	0.0901
Chlamydia trachomatis	oxoacyl-ACP synthase III	0.0311	0.3012	0.5
Leishmania major	beta tubulin	0.0057	0.0351	0.135

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	1 uM	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of BAZ2B. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504391]	ChEMBL.	No reference
Potency (binding)	= 5.0119 um	PUBCHEM_BIOASSAY: qHTS Assay for Identification of Novel General Anesthetics. In this assay, a GABAergic mimetic model system, apoferritin and a profluorescent 1-aminoanthracene ligand (1-AMA), was used to construct a competitive binding assay for identification of novel general anesthetics (Class of assay: confirmatory) [Related pubchem assays: 2385 (Probe Development Summary for Identification of Novel General Anesthetics), 2323 (Validation apoferritin assay run on SigmaAldrich LOPAC1280 collection)]	ChEMBL.	No reference
Potency (functional)	6.3096 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of binding or entry into cells for Lassa Virus. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID463114, AID540249]	ChEMBL.	No reference
Potency (functional)	16.3601 uM	PUBCHEM_BIOASSAY: Nrf2 qHTS screen for inhibitors. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493153, AID493163, AID504648]	ChEMBL.	No reference
Potency (functional)	89.1251 uM	PubChem BioAssay. qHTS of PTHR Inhibitors: Primary Screen. (Class of assay: confirmatory)	ChEMBL.	No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Homo sapiens	ChEMBL23

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: CHEMBL1552717

Bibliographic References

No literature references available for this target.

If you have references for this compound, please enter them in a user comment (below) or Contact us.

Detailed information for compound 1409415