TDR Targets

Basic information

Technical information

TDR Targets ID: 985581
Name: [(4aS,4bR,8R,8aR,9R,10aR)-2-ethenyl-8-(hydrox ymethyl)-1,4b,8-trimethyl-3,4,4a,5,6,7,8a,9,1 0,10a-decahydrophenanthren-9-yl] acetate
MW: 346.504 | Formula: C22H34O3
H donors: 1 H acceptors: 2 LogP: 4.39 Rotable bonds: 4
Rule of 5 violations (Lipinski): 1
SMILES: C=CC1=C(C)[C@H]2[C@H](CC1)[C@@]1(C)CCC[C@@]([C@@H]1[C@@H](C2)OC(=O)C)(C)CO
InChi: 1S/C22H34O3/c1-6-16-8-9-18-17(14(16)2)12-19(25-15(3)24)20-21(4,13-23)10-7-11-22(18,20)5/h6,17-20,23H,1,7-13H2,2-5H3/t17-,18-,19+,20-,21-,22+/m0/s1
InChiKey: XPBOSVHDPKPTRS-KINXCBNHSA-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

[(4aS,4bR,8R,8aR,9R,10aR)-8-(hydroxymethyl)-1,4b,8-trimethyl-2-vinyl-3,4,4a,5,6,7,8a,9,10,10a-decahydrophenanthren-9-yl] acetate
acetic acid [(4aS,4bR,8R,8aR,9R,10aR)-8-(hydroxymethyl)-1,4b,8-trimethyl-2-vinyl-3,4,4a,5,6,7,8a,9,10,10a-decahydrophenanthren-9-yl] ester
acetic acid [(4aS,4bR,8R,8aR,9R,10aR)-1,4b,8-trimethyl-8-methylol-2-vinyl-3,4,4a,5,6,7,8a,9,10,10a-decahydrophenanthren-9-yl] ester
[(4aS,4bR,8R,8aR,9R,10aR)-2-ethenyl-8-(hydroxymethyl)-1,4b,8-trimethyl-3,4,4a,5,6,7,8a,9,10,10a-decahydrophenanthren-9-yl] ethanoate

Targets

Known targets for this compound

No curated genes were found associated with this compound

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
Plasmodium vivax	cysteine--tRNA ligase, putative	0.002	0.0015	0.0075
Entamoeba histolytica	valyl-tRNA synthetase, putative	0.0047	0.0221	0.2423
Schistosoma mansoni	arginyl-tRNA synthetase	0.003	0.0094	0.1
Mycobacterium tuberculosis	Probable formamidopyrimidine-DNA glycosylase Fpg (FAPY-DNA glycosylase)	0.0096	0.0591	0.0573
Onchocerca volvulus		0.0104	0.0653	1
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0221	0.2556
Trypanosoma cruzi	leucyl-tRNA synthetase, putative	0.0047	0.0221	0.248
Toxoplasma gondii	tRNA synthetase, putative	0.0047	0.0221	0.0239
Mycobacterium ulcerans	cysteinyl-tRNA synthetase	0.1343	1	1
Echinococcus granulosus	valyl tRNA synthetase	0.0047	0.0221	0.2556
Echinococcus multilocularis	leucyl tRNA synthetase	0.0047	0.0221	0.2556
Plasmodium falciparum	cysteine--tRNA ligase	0.002	0.0015	0.0069
Trichomonas vaginalis	valyl-tRNA synthetase, putative	0.0028	0.008	0.0922
Plasmodium vivax	hypothetical protein, conserved	0.0047	0.0221	0.248
Loa Loa (eye worm)	cysteinyl tRNA synthetase 1	0.002	0.0015	0.0175
Loa Loa (eye worm)	VRS-2 protein	0.0019	0.0009	0.0101
Echinococcus granulosus	cysteinyl tRNA synthetase	0.002	0.0015	0.0175
Trypanosoma cruzi	valyl-tRNA synthetase, putative	0.0028	0.008	0.083
Plasmodium vivax	valine--tRNA ligase, putative	0.0047	0.0221	0.248
Onchocerca volvulus		0.0021	0.0024	0.0138
Mycobacterium ulcerans	peptide synthetase Nrp (peptide synthase)	0.0041	0.0176	0.0161
Trichomonas vaginalis	isoleucyl, leucyl, tyrosyl, valyl and methionyl-tRNA synthetases, putative	0.0019	0.0009	0.0101
Brugia malayi	arginyl aa-tRNA synthetase protein 1	0.003	0.0094	0.1
Schistosoma mansoni	isoleucine--tRNA ligase	0.0132	0.0865	1
Trichomonas vaginalis	isoleucyl, leucyl, tyrosyl, valyl and methionyl-tRNA synthetases, putative	0.0028	0.008	0.0922
Echinococcus granulosus	valyl tRNA synthetase	0.0047	0.0221	0.2556
Toxoplasma gondii	leucyl-tRNA synthetase (LeuRS2)	0.0047	0.0221	0.0239
Chlamydia trachomatis	methionine--tRNA ligase	0.0028	0.008	0.076
Trypanosoma cruzi	threonyl-tRNA synthetase, putative	0.0056	0.0289	0.3274
Leishmania major	leucyl-tRNA synthetase, putative	0.0047	0.0221	0.2423
Toxoplasma gondii	pantoate-beta-alanine ligase	0.1199	0.8912	1
Mycobacterium ulcerans	acyl-CoA synthetase	0.0021	0.0024	0.0009
Trichomonas vaginalis	threonyl-tRNA synthetase, putative	0.0049	0.0239	0.2764
Mycobacterium tuberculosis	Pantoate--beta-alanine ligase PanC (pantothenate synthetase) (pantoate activating enzyme)	0.1199	0.8912	0.891
Mycobacterium ulcerans	bifunctional enzyme MbtA: salicyl-AMP ligase (SAL-AMP ligase) + salicyl-S-ACP synthetase	0.0551	0.4023	0.4014
Mycobacterium leprae	Probable fatty-acid-CoA synthetase FadD22 (fatty-acid-CoA ligase) (fatty-acid-CoA synthase)	0.0021	0.0024	0.0005
Echinococcus multilocularis	isoleucyl tRNA synthetase, mitochondrial	0.0104	0.0653	0.7545
Mycobacterium leprae	Probable formamidopyrimidine-DNA glycosylase Fpg (FAPY-DNA GLYCOSYLASE)	0.0096	0.0591	0.0573
Echinococcus multilocularis	valyl tRNA synthetase	0.0047	0.0221	0.2556
Mycobacterium tuberculosis	Possible DNA glycosylase	0.0096	0.0591	0.0573
Trichomonas vaginalis	isoleucyl tRNA synthetase, putative	0.0132	0.0865	1
Mycobacterium ulcerans	leucyl-tRNA synthetase	0.0028	0.008	0.0065
Mycobacterium leprae	Probable pantoate--beta-alanine ligase PanC (pantothenate synthetase) (pantoate activating enzyme)	0.1199	0.8912	0.891
Mycobacterium ulcerans	phenolpthiocerol synthesis type-I polyketide synthase PpsE	0.0028	0.0079	0.0064
Plasmodium falciparum	cysteine--tRNA ligase	0.002	0.0015	0.0069
Plasmodium vivax	isoleucine--tRNA ligase, putative	0.0132	0.0865	1
Chlamydia trachomatis	valine--tRNA ligase	0.0047	0.0221	0.2423
Mycobacterium ulcerans	threonyl-tRNA synthetase	0.0049	0.0239	0.0224
Plasmodium falciparum	isoleucine--tRNA ligase, putative	0.0132	0.0865	0.9152
Brugia malayi	isoleucyl-tRNA synthetase family protein	0.0132	0.0865	1
Loa Loa (eye worm)	hypothetical protein	0.002	0.0015	0.0175
Brugia malayi	leucyl-tRNA synthetase	0.0047	0.0221	0.248
Mycobacterium tuberculosis	P-hydroxybenzoyl-AMP ligase FadD22	0.0021	0.0024	0.0005
Loa Loa (eye worm)	AMP-binding enzyme family protein	0.0041	0.0176	0.2034
Mycobacterium ulcerans	thioesterase	0.0332	0.2372	0.2361
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0009	0.0101
Trypanosoma cruzi	threonyl-tRNA synthetase, putative	0.0056	0.0289	0.3274
Giardia lamblia	Threonyl-tRNA synthetase	0.0049	0.0239	0.2764
Trypanosoma cruzi	arginyl-tRNA synthetase, putative	0.003	0.0094	0.1
Mycobacterium ulcerans	arginyl-tRNA synthetase	0.003	0.0094	0.0079
Trichomonas vaginalis	leucyl-tRNA synthetase, putative	0.0028	0.008	0.0922
Brugia malayi	valyl-tRNA synthetase family protein	0.0047	0.0221	0.248
Loa Loa (eye worm)	hypothetical protein	0.0132	0.0865	1
Schistosoma mansoni	methyltransferase-related	0.0024	0.0046	0.0441
Giardia lamblia	Cysteinyl-tRNA synthetase	0.002	0.0015	0.0175
Plasmodium falciparum	valine--tRNA ligase, putative	0.0047	0.0221	0.2269
Onchocerca volvulus		0.0041	0.0176	0.2522
Mycobacterium tuberculosis	Conserved protein	0.0024	0.0046	0.0027
Mycobacterium tuberculosis	Bifunctional enzyme MbtA: salicyl-AMP ligase (SAL-AMP ligase) + salicyl-S-ArCP synthetase	0.0551	0.4023	0.4011
Chlamydia trachomatis	isoleucine--tRNA ligase	0.0132	0.0865	1
Brugia malayi	oxidoreductase, short chain dehydrogenase/reductase family protein	0.0021	0.0024	0.0178
Trypanosoma cruzi	cysteinyl-tRNA synthetase, putative	0.002	0.0015	0.0075
Schistosoma mansoni	valine-tRNA ligase	0.0047	0.0221	0.248
Wolbachia endosymbiont of Brugia malayi	isoleucyl-tRNA synthetase	0.0132	0.0865	1
Mycobacterium leprae	Probable threonyl-tRNA synthetase ThrS (threonine-tRNA synthetase) (ThrRS) (Threonine-tRNA ligase)	0.0049	0.0239	0.022
Toxoplasma gondii	cysteine-tRNA synthetase (CysRS)	0.002	0.0015	0.0007
Leishmania major	hypothetical protein, conserved	0.0024	0.0046	0.0369
Loa Loa (eye worm)	threonyl-tRNA synthetase	0.0056	0.0289	0.3341
Loa Loa (eye worm)	hypothetical protein	0.0104	0.0653	0.7545
Mycobacterium tuberculosis	Cysteine:1D-myo-inosityl 2-amino-2-deoxy--D-glucopyranoside ligase MshC	0.1343	1	1
Echinococcus granulosus	leucyl tRNA synthetase	0.0047	0.0221	0.2556
Trypanosoma brucei	valyl-tRNA synthetase, putative	0.0047	0.0221	0.2423
Echinococcus multilocularis	Threonyl tRNA synthetase, C	0.0056	0.0289	0.3341
Mycobacterium tuberculosis	Peptide synthetase MbtF (peptide synthase)	0.0041	0.0176	0.0157
Giardia lamblia	Valine-tRNA ligase	0.0047	0.0221	0.2556
Trypanosoma brucei	arginyl-tRNA synthetase, putative	0.003	0.0094	0.0932
Brugia malayi	Methyltransferase-like protein 4	0.0024	0.0046	0.0441
Echinococcus multilocularis	leucyl tRNA synthetase	0.0047	0.0221	0.2556
Mycobacterium tuberculosis	Phenyloxazoline synthase MbtB (phenyloxazoline synthetase)	0.1077	0.7989	0.7985
Chlamydia trachomatis	threonine--tRNA ligase	0.0056	0.0289	0.3223
Entamoeba histolytica	valyl tRNA synthetase, putative	0.0047	0.0221	0.2423
Plasmodium falciparum	valine--tRNA ligase, putative	0.0047	0.0221	0.2269
Echinococcus granulosus	leucyl tRNA synthetase	0.0066	0.0369	0.4263
Echinococcus granulosus	isoleucyl tRNA synthetase, cytoplasmic	0.0132	0.0865	1
Mycobacterium ulcerans	non-ribosomal peptide synthetase MbtE	0.0041	0.0176	0.0161
Treponema pallidum	isoleucyl-tRNA synthetase	0.0132	0.0865	1
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0021	0.0024	0.0104
Plasmodium falciparum	threonine--tRNA ligase	0.0049	0.0239	0.2462
Chlamydia trachomatis	leucine--tRNA ligase	0.0028	0.008	0.076
Mycobacterium tuberculosis	Peptide synthetase MbtE (peptide synthase)	0.0041	0.0176	0.0157
Toxoplasma gondii	threonyl-tRNA synthetase family protein	0.0049	0.0239	0.0259
Schistosoma mansoni	cysteinyl-tRNA synthetase	0.002	0.0015	0.0075
Mycobacterium tuberculosis	Probable valyl-tRNA synthase protein ValS (valyl-tRNA synthetase) (valine--tRNA ligase) (valine translase)	0.0047	0.0221	0.0202
Mycobacterium tuberculosis	Probable peptide synthetase Nrp (peptide synthase)	0.0041	0.0176	0.0157
Brugia malayi	AMP-binding enzyme family protein	0.003	0.0093	0.0983
Mycobacterium tuberculosis	Probable threonyl-tRNA synthetase ThrS (threonine-tRNA synthetase)(ThrRS) (threonine-tRNA ligase)	0.0049	0.0239	0.022
Trypanosoma cruzi	isoleucyl-tRNA synthetase, putative	0.0132	0.0865	1
Echinococcus granulosus	isoleucyl trna synthetase mitochondrial	0.0104	0.0653	0.7545
Wolbachia endosymbiont of Brugia malayi	threonyl-tRNA synthetase	0.0049	0.0239	0.2635
Mycobacterium ulcerans	polyketide synthase associated protein PapA3	0.002	0.0019	0.0004
Trichomonas vaginalis	valyl-tRNA synthetase, putative	0.0019	0.0009	0.0101
Giardia lamblia	Methyltransferase like 2	0.0024	0.0046	0.0537
Loa Loa (eye worm)	isoleucyl-tRNA synthetase	0.0132	0.0865	1
Entamoeba histolytica	arginyl-tRNA synthetase	0.003	0.0094	0.0932
Trypanosoma cruzi	cysteinyl-tRNA synthetase, putative	0.002	0.0015	0.0075
Plasmodium falciparum	arginine--tRNA ligase	0.003	0.0094	0.0915
Mycobacterium tuberculosis	Isoleucyl-tRNA synthetase IleS	0.0085	0.0511	0.0493
Trichomonas vaginalis	conserved hypothetical protein	0.0024	0.0046	0.0537
Giardia lamblia	Isoleucyl-tRNA synthetase	0.0132	0.0865	1
Plasmodium falciparum	leucine--tRNA ligase, putative	0.0047	0.0221	0.2269
Trichomonas vaginalis	leucyl-tRNA synthetase, putative	0.0047	0.0221	0.2556
Plasmodium vivax	threonine--tRNA ligase, putative	0.0049	0.0239	0.269
Mycobacterium ulcerans	formamidopyrimidine-DNA glycosylase	0.0096	0.0591	0.0577
Mycobacterium leprae	isoleucyl-tRNA synthetase IleS	0.0132	0.0865	0.0847
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0009	0.0101
Schistosoma mansoni	cysteinyl-tRNA synthetase	0.002	0.0015	0.0075
Loa Loa (eye worm)	hypothetical protein	0.003	0.0093	0.1074
Mycobacterium ulcerans	formamidopyrimidine-DNA glycosylase	0.0096	0.0591	0.0577
Onchocerca volvulus		0.0041	0.0176	0.2522
Brugia malayi	cysteinyl tRNA synthetase protein 1	0.002	0.0015	0.0075
Echinococcus multilocularis	arginyl tRNA synthetase, cytoplasmic	0.003	0.0094	0.1091
Schistosoma mansoni	methionine-tRNA synthetase	0.0028	0.008	0.083
Echinococcus granulosus	methionyl tRNA synthetase cytoplasmic	0.0028	0.008	0.0922
Schistosoma mansoni	isoleucine--tRNA ligase	0.0132	0.0865	1
Leishmania major	threonyl-tRNA synthetase, putative	0.0056	0.0289	0.3223
Echinococcus granulosus	arginyl tRNA synthetase cytoplasmic	0.003	0.0094	0.1091
Mycobacterium ulcerans	pantoate--beta-alanine ligase	0.1199	0.8912	0.891
Trichomonas vaginalis	valyl-tRNA synthetase, putative	0.0019	0.0009	0.0101
Trypanosoma cruzi	valyl-tRNA synthetase, putative	0.0047	0.0221	0.248
Treponema pallidum	valyl-tRNA synthetase	0.0047	0.0221	0.2423
Treponema pallidum	leucyl-tRNA synthetase	0.0028	0.008	0.076
Trichomonas vaginalis	leucyl-tRNA synthetase, putative	0.0019	0.0009	0.0101
Schistosoma mansoni	valine-tRNA ligase	0.0047	0.0221	0.248
Mycobacterium ulcerans	phenyloxazoline synthase MbtB	0.0373	0.2681	0.267
Echinococcus multilocularis	methionyl tRNA synthetase, cytoplasmic	0.0028	0.008	0.0922
Echinococcus multilocularis	cysteinyl tRNA synthetase	0.002	0.0015	0.0175
Plasmodium vivax	arginyl-tRNA synthetase, putative	0.003	0.0094	0.1
Loa Loa (eye worm)	hypothetical protein	0.0019	0.0009	0.0101
Brugia malayi	AMP-binding enzyme family protein	0.0041	0.0176	0.1953
Toxoplasma gondii	isoleucyl-tRNA synthetase, putative	0.0047	0.0221	0.0239
Plasmodium falciparum	isoleucine--tRNA ligase, putative	0.0143	0.0945	1
Mycobacterium ulcerans	non-ribosomal peptide synthetase MbtF	0.0041	0.0176	0.0161
Toxoplasma gondii	valyl-tRNA synthetase	0.0047	0.0221	0.0239
Leishmania major	valyl-tRNA synthetase, putative	0.0047	0.0221	0.2423
Schistosoma mansoni	leucyl-tRNA synthetase	0.0047	0.0221	0.248
Onchocerca volvulus		0.0028	0.008	0.1013
Schistosoma mansoni	threonyl-tRNA synthetase	0.0045	0.0203	0.2272
Chlamydia trachomatis	arginine--tRNA ligase	0.003	0.0094	0.0932
Brugia malayi	threonyl-tRNA synthetase, cytoplasmic	0.0056	0.0289	0.3274
Giardia lamblia	Leucyl-tRNA synthetase	0.0019	0.0009	0.0101
Brugia malayi	Valyl-tRNA synthetase	0.0047	0.0221	0.248
Loa Loa (eye worm)	hypothetical protein	0.0028	0.008	0.0922
Wolbachia endosymbiont of Brugia malayi	valyl-tRNA synthetase	0.0047	0.0221	0.2423
Trichomonas vaginalis	valyl-tRNA synthetase, putative	0.0019	0.0009	0.0101
Treponema pallidum	threonyl-tRNA synthetase	0.0049	0.0239	0.2635
Mycobacterium tuberculosis	Hypothetical protein	0.0024	0.0046	0.0027
Entamoeba histolytica	leucyl-tRNA synthetase, putative	0.0047	0.0221	0.2423
Trypanosoma brucei	isoleucyl-tRNA synthetase, putative	0.0132	0.0865	1
Trypanosoma brucei	threonyl-tRNA synthetase, putative	0.0056	0.0289	0.3223
Treponema pallidum	arginyl-tRNA synthetase	0.003	0.0094	0.0932
Echinococcus granulosus	Threonyl tRNA synthetase C	0.0056	0.0289	0.3341
Brugia malayi	isoleucyl-tRNA synthetase	0.0132	0.0865	1
Wolbachia endosymbiont of Brugia malayi	arginyl-tRNA synthetase	0.003	0.0094	0.0932
Mycobacterium leprae	PHENOLPTHIOCEROL SYNTHESIS TYPE-I POLYKETIDE SYNTHASE PPSE	0.0028	0.0079	0.006
Entamoeba histolytica	threonyl-tRNA synthetase, putative	0.0049	0.0239	0.2635
Mycobacterium ulcerans	isoleucyl-tRNA synthetase	0.0132	0.0865	0.0851
Leishmania major	isoleucyl-tRNA synthetase, putative	0.0132	0.0865	1
Wolbachia endosymbiont of Brugia malayi	formamidopyrimidine-DNA glycosylase	0.0096	0.0591	0.6772
Trichomonas vaginalis	leucyl-tRNA synthetase, putative	0.0047	0.0221	0.2556
Toxoplasma gondii	isoleucyl-tRNA synthetase family protein	0.0132	0.0865	0.0962
Trichomonas vaginalis	cysteinyl-tRNA synthetase, putative	0.002	0.0015	0.0175
Onchocerca volvulus		0.0047	0.0221	0.323
Mycobacterium ulcerans	valyl-tRNA synthetase	0.0047	0.0221	0.0206
Wolbachia endosymbiont of Brugia malayi	leucyl-tRNA synthetase	0.0047	0.0221	0.2423
Toxoplasma gondii	leucyl-tRNA synthetase	0.0047	0.0221	0.0239
Trypanosoma brucei	leucyl-tRNA synthetase, putative	0.0047	0.0221	0.2423
Echinococcus multilocularis	isoleucyl tRNA synthetase, cytoplasmic	0.0132	0.0865	1
Echinococcus multilocularis	valyl tRNA synthetase	0.0047	0.0221	0.2556
Leishmania major	arginyl-tRNA synthetase, putative	0.003	0.0094	0.0932
Loa Loa (eye worm)	hypothetical protein	0.0028	0.008	0.0922
Entamoeba histolytica	isoleucyl-tRNA synthetase, putative	0.0132	0.0865	1
Mycobacterium leprae	PROBABLE VALYL-tRNA SYNTHASE PROTEIN VALS (VALYL-tRNA SYNTHETASE) (VALINE--tRNA LIGASE) (VALINE TRANSLASE) ELONGS TO CLASS-I AMI	0.0047	0.0221	0.0202

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (functional)	= 56.7 uM	Antitrypanosomal activity against extracellular Trypanosoma cruzi Tulahuen clone C4	ChEMBL.	15497945
IC50 (functional)	= 76.5 uM	Antitrypanosomal activity against intracellular Trypanosoma cruzi Tulahuen clone C4 assessed as cleavage of chlorophenol red-beta-D-galactosidase	ChEMBL.	15497945

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: CHEMBL482794

Bibliographic References

No literature references available for this target.

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Detailed information for compound 985581