TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 432.47 | Formula: C23H17FN4O2S
H donors: 1 H acceptors: 2 LogP: 4.32 Rotable bonds: 5
Rule of 5 violations (Lipinski): 1
SMILES: Fc1cccc(c1)COc1cccc2c1c(/C=C/1\C(=O)NN=C1c1nccs1)cn2C
InChi: 1S/C23H17FN4O2S/c1-28-12-15(11-17-21(26-27-22(17)29)23-25-8-9-31-23)20-18(28)6-3-7-19(20)30-13-14-4-2-5-16(24)10-14/h2-12H,13H2,1H3,(H,27,29)/b17-11-
InChiKey: ICOFBYGBWIFPCM-BOPFTXTBSA-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	insulin receptor	Starlite/ChEMBL	References
Homo sapiens	anaplastic lymphoma receptor tyrosine kinase	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Schistosoma mansoni	tyrosine kinase	Get druggable targets OG5_129857	All targets in OG5_129857
Echinococcus multilocularis	insulin growth factor 1 receptor beta	Get druggable targets OG5_129857	All targets in OG5_129857
Brugia malayi	Protein kinase domain containing protein	Get druggable targets OG5_132231	All targets in OG5_132231
Brugia malayi	Protein kinase domain containing protein	Get druggable targets OG5_129857	All targets in OG5_129857
Schistosoma japonicum	ko:K04527 insulin receptor, putative	Get druggable targets OG5_129857	All targets in OG5_129857
Schistosoma japonicum	IPR008957,Fibronectin, type III-like fold,domain-containing	Get druggable targets OG5_129857	All targets in OG5_129857
Echinococcus granulosus	insulin growth factor 1 receptor beta	Get druggable targets OG5_129857	All targets in OG5_129857
Echinococcus multilocularis	insulin receptor	Get druggable targets OG5_129857	All targets in OG5_129857
Loa Loa (eye worm)	TK/ALK protein kinase	Get druggable targets OG5_132231	All targets in OG5_132231
Schistosoma mansoni	tyrosine kinase	Get druggable targets OG5_129857	All targets in OG5_129857
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_132231	All targets in OG5_132231
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_129857	All targets in OG5_129857
Loa Loa (eye worm)	TK/INSR protein kinase	Get druggable targets OG5_129857	All targets in OG5_129857
Schistosoma japonicum	Insulin-like peptide receptor precursor, putative	Get druggable targets OG5_129857	All targets in OG5_129857
Brugia malayi	Protein kinase domain containing protein	Get druggable targets OG5_129857	All targets in OG5_129857
Schistosoma japonicum	ko:K08252 receptor protein-tyrosine kinase [EC2.7.10.1], putative	Get druggable targets OG5_129857	All targets in OG5_129857
Echinococcus granulosus	insulin receptor	Get druggable targets OG5_129857	All targets in OG5_129857
Schistosoma japonicum	Insulin-like peptide receptor precursor, putative	Get druggable targets OG5_129857	All targets in OG5_129857
Schistosoma japonicum	IPR000494,EGF receptor, L domain,domain-containing	Get druggable targets OG5_129857	All targets in OG5_129857

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 granulosus	geminin	0.0165	0.0599	0.0599
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0059	0.016	0.016
Schistosoma mansoni	tyrosine kinase	0.0159	0.0575	0.0575
Giardia lamblia	Ceramide glucosyltransferase	0.1103	0.4486	1
Brugia malayi	O-Glycosyl hydrolase family 30 protein	0.1132	0.4608	0.4607
Toxoplasma gondii	HEAT repeat-containing protein	0.0028	0.0031	0.0246
Onchocerca volvulus	Ceramide glucosyltransferase homolog	0.2432	1	1
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0045	0.0099	0.0099
Brugia malayi	Alpha-L-fucosidase family protein	0.1	0.4061	0.4061
Echinococcus multilocularis	MAM	0.0034	0.0055	0.0055
Brugia malayi	Amylo-alpha-1,6-glucosidase family protein	0.0148	0.0527	0.0526
Trichomonas vaginalis	glucosylceramidase, putative	0.0783	0.3159	0.6857
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0049	0.0116	0.0116
Plasmodium falciparum	ataxin-2 like protein, putative	0.0025	0.0016	0.5234
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.0099	0.0099
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.0099	0.0099
Loa Loa (eye worm)	hypothetical protein	0.1123	0.457	0.457
Schistosoma mansoni	tyrosine kinase	0.0071	0.0207	0.0207
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0045	0.0099	0.0099
Echinococcus multilocularis	insulin growth factor 1 receptor beta	0.0159	0.0575	0.0575
Schistosoma mansoni	tyrosine kinase	0.0073	0.0218	0.0218
Echinococcus multilocularis	geminin	0.0165	0.0599	0.0599
Schistosoma mansoni	cpg binding protein	0.0028	0.003	0.003
Schistosoma mansoni	hypothetical protein	0.019	0.0701	0.0701
Trypanosoma cruzi	hypothetical protein, conserved	0.0322	0.1248	1
Brugia malayi	Glycosyl hydrolases family 31 protein	0.0322	0.1248	0.1248
Schistosoma mansoni	alpha-glucosidase	0.1499	0.6128	0.6128
Trypanosoma cruzi	PAB1-binding protein , putative	0.0025	0.0016	0.0129
Trichomonas vaginalis	glucosylceramidase, putative	0.1132	0.4608	1
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0016	0.0016
Brugia malayi	hypothetical protein	0.0033	0.0052	0.0052
Trypanosoma cruzi	PAB1-binding protein , putative	0.0025	0.0016	0.0129
Trichomonas vaginalis	glucosylceramidase, putative	0.0743	0.2994	0.6497
Trichomonas vaginalis	alpha-glucosidase, putative	0.0144	0.0511	0.1109
Echinococcus multilocularis	importin subunit beta 1	0.0028	0.0031	0.0031
Trichomonas vaginalis	glycogen debranching enzyme, putative	0.0148	0.0527	0.1143
Trichomonas vaginalis	glucosylceramidase, putative	0.0743	0.2994	0.6497
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0045	0.0099	0.0099
Schistosoma mansoni	hypothetical protein	0.0107	0.0357	0.0356
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0045	0.0099	0.0099
Echinococcus multilocularis	dnaJ subfamily B	0.0399	0.1567	0.1567
Schistosoma mansoni	cpg binding protein	0.003	0.0037	0.0037
Schistosoma mansoni	ceramide glucosyltransferase	0.2432	1	1
Loa Loa (eye worm)	glycosyl hydrolase family 31 protein	0.1676	0.6865	0.6865
Schistosoma mansoni	alpha-glucosidase	0.1499	0.6128	0.6128
Loa Loa (eye worm)	TK/ALK protein kinase	0.0287	0.1103	0.1102
Echinococcus multilocularis	cpg binding protein	0.003	0.0037	0.0037
Echinococcus granulosus	fucosidase alpha L 1 tissue	0.1164	0.4739	0.4739
Trichomonas vaginalis	maltase-glucoamylase, putative	0.0322	0.1248	0.2709
Trichomonas vaginalis	glucosylceramidase, putative	0.1132	0.4608	1
Schistosoma mansoni	hypothetical protein	0.0033	0.0052	0.0052
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0045	0.0099	0.0099
Toxoplasma gondii	Amylo-alpha-1,6-glucosidase	0.0148	0.0527	0.4218
Trichomonas vaginalis	glycogen debranching enzyme, putative	0.0148	0.0527	0.1143
Loa Loa (eye worm)	nucleolar RNA-associated protein alpha	0.03	0.1158	0.1158
Loa Loa (eye worm)	hypothetical protein	0.0144	0.0511	0.0511
Echinococcus granulosus	cpg binding protein	0.003	0.0037	0.0037
Loa Loa (eye worm)	amylo-alpha-1,6-glucosidase	0.0072	0.0212	0.0212
Trichomonas vaginalis	alpha-glucosidase, putative	0.0144	0.0511	0.1109
Onchocerca volvulus		0.0034	0.0055	0.0025
Trypanosoma brucei	importin beta-1 subunit, putative	0.0028	0.0031	0.0246
Echinococcus granulosus	lysosomal alpha glucosidase	0.1676	0.6865	0.6865
Plasmodium falciparum	importin beta, putative	0.0028	0.0031	1
Onchocerca volvulus		0.1007	0.4089	0.4071
Trichomonas vaginalis	alpha-glucosidase, putative	0.0322	0.1248	0.2709
Entamoeba histolytica	hypothetical protein	0.0023	0.0009	0.007
Schistosoma mansoni	bile acid beta-glucosidase-related	0.1664	0.6812	0.6812
Echinococcus multilocularis	GTP binding nuclear protein Ran	0.0021	0.000008454	0.000008454
Trichomonas vaginalis	glucosylceramidase, putative	0.0743	0.2994	0.6497
Schistosoma mansoni	hypothetical protein	0.0399	0.1567	0.1567
Echinococcus granulosus	melanoma receptor tyrosine protein kinase	0.0073	0.0218	0.0218
Plasmodium vivax	ataxin-2 like protein, putative	0.0025	0.0016	0.5234
Trichomonas vaginalis	alpha-glucosidase, putative	0.0322	0.1248	0.2709
Schistosoma mansoni	tyrosine kinase	0.0159	0.0575	0.0575
Brugia malayi	Protein kinase domain containing protein	0.0287	0.1103	0.1103
Echinococcus multilocularis	atpase aaa+ type core atpase aaa type core	0.079	0.3191	0.3191
Loa Loa (eye worm)	alpha-L-fucosidase	0.1	0.4061	0.4061
Trichomonas vaginalis	alpha-L-fucosidase, putative	0.0439	0.1734	0.3762
Entamoeba histolytica	glycogen debranching enzyme, putative	0.0148	0.0527	0.4218
Onchocerca volvulus	Uncharacterized family 31 glucosidase KIAA1161 homolog	0.0144	0.0511	0.0482
Loa Loa (eye worm)	TK/EGFR protein kinase	0.0073	0.0218	0.0218
Brugia malayi	Protein kinase domain containing protein	0.0159	0.0575	0.0575
Loa Loa (eye worm)	O-glycosyl hydrolase family 30 protein	0.1132	0.4608	0.4607
Echinococcus granulosus	snurportin 1	0.03	0.1158	0.1158
Echinococcus granulosus	bile acid beta glucosidase	0.1664	0.6812	0.6812
Echinococcus multilocularis	glycogen debranching enzyme	0.0148	0.0527	0.0527
Trypanosoma brucei	glucosidase, putative	0.0322	0.1248	1
Echinococcus multilocularis	neutral alpha glucosidase AB	0.0322	0.1248	0.1248
Echinococcus granulosus	importin subunit beta 1	0.0028	0.0031	0.0031
Schistosoma mansoni	hypothetical protein	0.03	0.1158	0.1158
Trypanosoma cruzi	hypothetical protein, conserved	0.0322	0.1248	1
Leishmania major	hypothetical protein, conserved	0.0025	0.0016	0.0129
Schistosoma mansoni	alpha glucosidase	0.0322	0.1248	0.1248
Trichomonas vaginalis	conserved hypothetical protein	0.0076	0.0229	0.0496
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0045	0.0099	0.0099
Toxoplasma gondii	glycosyl hydrolase, family 31 protein	0.0322	0.1248	1
Echinococcus multilocularis	ceramide glucosyltransferase	0.2432	1	1
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0045	0.0099	0.0099
Schistosoma mansoni	cpg binding protein	0.003	0.0037	0.0037
Echinococcus granulosus	non lysosomal glucosylceramidase	0.1664	0.6812	0.6812
Onchocerca volvulus		0.0034	0.0055	0.0025
Trichomonas vaginalis	Importin beta-1 subunit, putative	0.0023	0.0009	0.0019
Trypanosoma brucei	PAB1-binding protein , putative	0.0025	0.0016	0.0129
Trichomonas vaginalis	glucosylceramidase, putative	0.0743	0.2994	0.6497
Echinococcus multilocularis	lysosomal alpha glucosidase	0.1676	0.6865	0.6865
Trypanosoma brucei	importin beta-1 subunit, putative	0.0028	0.0031	0.0246
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0028	0.003	0.003
Leishmania major	glycosyl hydrolase-like protein	0.0144	0.0511	0.4093
Onchocerca volvulus	Glucosylceramidase homolog	0.0743	0.2994	0.2972
Leishmania major	alpha glucosidase II subunit, putative	0.0322	0.1248	1
Trichomonas vaginalis	alpha-glucosidase, putative	0.0322	0.1248	0.2709
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0055	0.0055
Echinococcus multilocularis	non lysosomal glucosylceramidase	0.1664	0.6812	0.6812
Toxoplasma gondii	LsmAD domain-containing protein	0.0025	0.0016	0.0129
Trichomonas vaginalis	alpha-glucosidase, putative	0.0144	0.0511	0.1109
Schistosoma mansoni	alpha-l-fucosidase	0.1	0.4061	0.4061
Entamoeba histolytica	glycosyl hydrolase, family 31 protein	0.0322	0.1248	1
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0031	0.0031
Loa Loa (eye worm)	hypothetical protein	0.0148	0.0527	0.0526
Echinococcus multilocularis	fucosidase, alpha L 1, tissue	0.1164	0.4739	0.4739
Brugia malayi	Glycosyl hydrolases family 31 protein	0.1676	0.6865	0.6865
Trichomonas vaginalis	alpha-glucosidase, putative	0.0144	0.0511	0.1109
Echinococcus granulosus	MAM	0.0034	0.0055	0.0055
Trichomonas vaginalis	alpha-L-fucosidase, putative	0.0439	0.1734	0.3762
Schistosoma mansoni	tyrosine kinase	0.0073	0.0218	0.0218
Trichomonas vaginalis	glucosylceramidase, putative	0.1132	0.4608	1
Leishmania major	importin beta-1 subunit, putative	0.0023	0.0009	0.007
Echinococcus multilocularis	bile acid beta glucosidase	0.1664	0.6812	0.6812
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0055	0.0055
Trichomonas vaginalis	alpha-glucosidase, putative	0.0322	0.1248	0.2709
Schistosoma mansoni	importin beta-1	0.0028	0.0031	0.0031
Echinococcus granulosus	epidermal growth factor receptor	0.0073	0.0218	0.0218
Brugia malayi	CXXC zinc finger family protein	0.0028	0.003	0.003
Schistosoma mansoni	tyrosine kinase	0.0071	0.0207	0.0207
Trichomonas vaginalis	alpha-glucosidase, putative	0.0144	0.0511	0.1109
Trichomonas vaginalis	neutral alpha-glucosidase ab precursor, putative	0.0322	0.1248	0.2709
Trichomonas vaginalis	maltase-glucoamylase, putative	0.0144	0.0511	0.1109
Trypanosoma cruzi	glycosyl hydrolase-like protein, putative	0.0144	0.0511	0.4093
Echinococcus granulosus	insulin receptor	0.0159	0.0575	0.0575
Echinococcus multilocularis	insulin receptor	0.0159	0.0575	0.0575
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0052	0.0052
Schistosoma mansoni	hypothetical protein	0.0034	0.0055	0.0055
Plasmodium vivax	importin-beta 2, putative	0.0028	0.0031	1
Brugia malayi	Furin-like cysteine rich region family protein	0.0073	0.0218	0.0218
Schistosoma mansoni	tyrosine kinase	0.0073	0.0218	0.0218
Echinococcus multilocularis	lysosomal alpha glucosidase	0.1676	0.6865	0.6865
Echinococcus granulosus	glycogen debranching enzyme	0.0148	0.0527	0.0526
Schistosoma mansoni	hypothetical protein	0.0165	0.0599	0.0599
Brugia malayi	hypothetical protein	0.0025	0.0016	0.0016
Echinococcus granulosus	dnaJ subfamily B	0.0399	0.1567	0.1567
Trichomonas vaginalis	neutral alpha-glucosidase ab precursor, putative	0.0144	0.0511	0.1109
Loa Loa (eye worm)	ceramide glucosyltransferase	0.2432	1	1
Trypanosoma cruzi	importin beta-1 subunit, putative	0.0023	0.0009	0.007
Giardia lamblia	4-alpha-glucanotransferase, amylo-alpha-1,6-glucosidase	0.0148	0.0527	0.1173
Echinococcus granulosus	ceramide glucosyltransferase	0.2432	1	1
Trichomonas vaginalis	glucosylceramidase, putative	0.0743	0.2994	0.6497
Brugia malayi	latrophilin 2 splice variant baaae	0.0033	0.0052	0.0052
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0049	0.0116	0.0116
Trichomonas vaginalis	alpha-glucosidase, putative	0.0322	0.1248	0.2709
Schistosoma mansoni	ceramide glucosyltransferase	0.2432	1	1
Plasmodium falciparum	ataxin-2 like protein, putative	0.0025	0.0016	0.5234
Trichomonas vaginalis	glucosylceramidase, putative	0.1132	0.4608	1
Echinococcus granulosus	insulin growth factor 1 receptor beta	0.0159	0.0575	0.0575
Schistosoma mansoni	hypothetical protein	0.0034	0.0055	0.0055
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0053	0.0134	0.1074
Loa Loa (eye worm)	hypothetical protein	0.0034	0.0055	0.0055
Schistosoma mansoni	tyrosine kinase	0.0071	0.0207	0.0207
Loa Loa (eye worm)	glycosyl hydrolase family 31 protein	0.0322	0.1248	0.1248
Entamoeba histolytica	glycosyl hydrolase, family 31 protein	0.0144	0.0511	0.4093
Brugia malayi	RNA, U transporter 1	0.008	0.0246	0.0246
Brugia malayi	hypothetical protein	0.0034	0.0055	0.0055
Brugia malayi	Protein kinase domain containing protein	0.0089	0.0282	0.0282
Echinococcus multilocularis	epidermal growth factor receptor	0.0073	0.0218	0.0218
Echinococcus granulosus	neutral alpha glucosidase AB	0.0322	0.1248	0.1248
Trypanosoma cruzi	glycosyl hydrolase-like protein, putative	0.0144	0.0511	0.4093
Trichomonas vaginalis	Importin beta-1 subunit, putative	0.0023	0.0009	0.0019
Echinococcus granulosus	epidermal growth factor receptor	0.0073	0.0218	0.0218
Entamoeba histolytica	glycosyl hydrolase, family 31 protein	0.0322	0.1248	1
Loa Loa (eye worm)	hypothetical protein	0.0049	0.0116	0.0116
Brugia malayi	Glycosyl hydrolases family 31 protein	0.0144	0.0511	0.0511
Trichomonas vaginalis	neutral alpha-glucosidase ab precursor, putative	0.0322	0.1248	0.2709
Loa Loa (eye worm)	hypothetical protein	0.0086	0.0272	0.0272
Echinococcus multilocularis	epidermal growth factor receptor	0.0073	0.0218	0.0218
Trypanosoma brucei	glycosyl hydrolase-like protein	0.0144	0.0511	0.4093
Trichomonas vaginalis	glucosylceramidase, putative	0.0743	0.2994	0.6497
Trichomonas vaginalis	glucosylceramidase, putative	0.1132	0.4608	1
Trichomonas vaginalis	glucosylceramidase, putative	0.1132	0.4608	1
Trichomonas vaginalis	neutral alpha-glucosidase ab precursor, putative	0.0144	0.0511	0.1109
Echinococcus multilocularis	snurportin 1	0.03	0.1158	0.1158
Loa Loa (eye worm)	hypothetical protein	0.025	0.0951	0.0951
Trichomonas vaginalis	glucosylceramidase, putative	0.0743	0.2994	0.6497
Trichomonas vaginalis	importin beta-1, putative	0.0023	0.0009	0.0019
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0049	0.0116	0.0116
Schistosoma mansoni	bile acid beta-glucosidase-related	0.1664	0.6812	0.6812
Schistosoma mansoni	hypothetical protein	0.0165	0.0599	0.0599
Mycobacterium ulcerans	alpha-L-fucosidase	0.1164	0.4739	0.5
Brugia malayi	Importin beta-1 subunit	0.0028	0.0031	0.0031
Trichomonas vaginalis	glucosylceramidase, putative	0.0783	0.3159	0.6857
Trichomonas vaginalis	sucrase-isomaltase, putative	0.0322	0.1248	0.2709
Loa Loa (eye worm)	TK/INSR protein kinase	0.0159	0.0575	0.0575

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 25 nM	Inhibition of ALK	ChEMBL.	22061645
IC50 (binding)	= 120 nM	Inhibition of nucleophosmin-fused ALK autophosphorylation in human Karpas299 cells	ChEMBL.	22061645
IC50 (binding)	> 1000 nM	Inhibition of GST-tagged intracellular domain of IR by homogeneous time-resolved fluorescence assay	ChEMBL.	22061645
Inhibition (binding)	= 50 %	Inhibition of human cytoplasmic domain of VEGFR-2 at 1 uM by time-resolved fluorescence assay	ChEMBL.	22061645
T1/2 (ADMET)	= 6 min	Half life in mouse liver microsomes	ChEMBL.	22061645

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: CHEMBL1922981

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 1577881