TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 555.573 | Formula: C29H33NO10
H donors: 5 H acceptors: 7 LogP: 1.54 Rotable bonds: 4
Rule of 5 violations (Lipinski): 2
SMILES: OC[C@@]1(O)C[C@H](O[C@H]2C[C@@H](O)[C@@H](C(O2)C)N2CCOCC2)c2c(C1)c(O)c1c(c2O)C(=O)c2c(C1=O)cccc2
InChi: 1S/C29H33NO10/c1-14-24(30-6-8-38-9-7-30)18(32)10-20(39-14)40-19-12-29(37,13-31)11-17-21(19)28(36)23-22(27(17)35)25(33)15-4-2-3-5-16(15)26(23)34/h2-5,14,18-20,24,31-32,35-37H,6-13H2,1H3/t14?,18-,19+,20+,24-,29+/m1/s1
InChiKey: FTQWUCZUYZLJOS-NBLGNCKZSA-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

No synonyms found for this compound

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
Schistosoma mansoni	rab geranylgeranyl transferase alpha subunit	0.0031	0.0375	0.0071
Mycobacterium ulcerans	phytoene synthase, CrtB	0.0079	0.2262	0.1638
Onchocerca volvulus		0.004	0.0747	0.2251
Leishmania major	hypothetical protein, conserved	0.0079	0.2262	0.2163
Trypanosoma brucei	DNA polymerase IV, putative	0.0087	0.2596	0.2853
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0311	0.0187
Brugia malayi	acetyltransferase, GNAT family protein	0.0146	0.491	0.4845
Echinococcus granulosus	histone acetyltransferase KAT2B	0.0043	0.0855	0.0906
Brugia malayi	beta-lactamase family protein	0.004	0.0747	0.0628
Schistosoma mansoni	hypothetical protein	0.0183	0.6362	0.6246
Loa Loa (eye worm)	hypothetical protein	0.0037	0.0613	0.0493
Echinococcus granulosus	fructose bisphosphate aldolase class I	0.0091	0.2766	0.4063
Echinococcus granulosus	dna polymerase eta	0.0031	0.0375	0.0113
Schistosoma mansoni	intermediate filament proteins	0.0029	0.0311	0.0005
Trypanosoma cruzi	squalene synthase, putative	0.0252	0.91	1
Trypanosoma cruzi	hypothetical protein, conserved	0.004	0.0747	0.0426
Toxoplasma gondii	fructose-1,6-bisphosphate aldolase	0.0091	0.2766	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0066	0.1763	0.1937
Trichomonas vaginalis	DNA polymerase eta, putative	0.0087	0.2596	0.1999
Echinococcus multilocularis	fructose bisphosphate aldolase class I	0.0091	0.2766	0.4063
Brugia malayi	fructose-bisphosphate aldolase 1	0.0091	0.2766	0.2674
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0307	0.0182
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription factor	0.0085	0.2494	0.3613
Trypanosoma brucei	hypothetical protein, conserved	0.004	0.0747	0.0821
Trypanosoma brucei	DNA polymerase eta, putative	0.0031	0.0375	0.0412
Toxoplasma gondii	histone lysine acetyltransferase GCN5-B	0.0043	0.0855	0.2853
Trypanosoma brucei	DNA polymerase kappa, putative	0.0087	0.2596	0.2853
Brugia malayi	fructose-bisphosphate aldolase 2	0.0091	0.2766	0.2674
Mycobacterium tuberculosis	Probable conserved lipoprotein	0.004	0.0747	0.0418
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0029	0.0307	0.0182
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0029	0.0307	0.0182
Echinococcus granulosus	lamin dm0	0.0029	0.0311	0.0008
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0256	0.9264	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0035	0.0551	0.0606
Brugia malayi	polk-prov protein	0.0066	0.1763	0.1657
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.004	0.0747	0.0454
Mycobacterium tuberculosis	Probable lipase LipD	0.004	0.0747	0.0418
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.004	0.0747	0.0628
Brugia malayi	hypothetical protein	0.0066	0.178	0.1674
Echinococcus multilocularis	fructose 1,6 bisphosphate aldolase	0.0091	0.2766	0.4063
Brugia malayi	beta-lactamase family protein	0.004	0.0747	0.0628
Loa Loa (eye worm)	steroid hormone receptor	0.0029	0.0307	0.0182
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0054	0.1283	0.1171
Schistosoma mansoni	lamin	0.0029	0.0311	0.0005
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0029	0.0307	0.0182
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0029	0.0307	0.0182
Trypanosoma cruzi	fructose-bisphosphate aldolase, glycosomal, putative	0.0091	0.2766	0.2741
Trypanosoma brucei	fructose-bisphosphate aldolase, glycosomal, putative	0.0091	0.2766	0.304
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.004	0.0747	0.0628
Echinococcus multilocularis	terminal deoxycytidyl transferase rev1	0.0031	0.0375	0.0113
Onchocerca volvulus		0.0066	0.178	0.7532
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0087	0.2596	0.2546
Loa Loa (eye worm)	hypothetical protein	0.0079	0.2262	0.2163
Entamoeba histolytica	hypothetical protein	0.0036	0.0592	0.6387
Trichomonas vaginalis	cat eye syndrome critical region protein 2, cscr2, putative	0.0043	0.0855	0.0117
Loa Loa (eye worm)	beta-lactamase	0.004	0.0747	0.0628
Schistosoma mansoni	fructose 16-bisphosphate aldolase	0.0091	0.2766	0.2538
Echinococcus granulosus	fructose 16 bisphosphate aldolase	0.0091	0.2766	0.4063
Trichomonas vaginalis	DNA polymerase IV / kappa, putative	0.0087	0.2596	0.1999
Mycobacterium tuberculosis	Probable hydrolase	0.004	0.0747	0.0418
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0029	0.0307	0.0182
Trypanosoma brucei	DNA polymerase IV, putative	0.0073	0.2045	0.2248
Trypanosoma cruzi	hypothetical protein, conserved	0.004	0.0747	0.0426
Mycobacterium tuberculosis	Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed))	0.0045	0.0926	0.062
Echinococcus multilocularis	lamin dm0	0.0029	0.0311	0.0008
Mycobacterium ulcerans	DNA polymerase IV	0.0087	0.2596	0.1999
Trypanosoma brucei	DNA polymerase kappa, putative	0.0087	0.2596	0.2853
Leishmania major	DNA polymerase kappa, putative,DNA polymerase IV, putative	0.0045	0.0926	0.0632
Brugia malayi	steroid hormone receptor	0.0029	0.0307	0.0182
Trypanosoma cruzi	fructose-bisphosphate aldolase, glycosomal, putative	0.0091	0.2766	0.2741
Echinococcus granulosus	lamin	0.0029	0.0311	0.0008
Toxoplasma gondii	ABC1 family protein	0.004	0.0747	0.2447
Brugia malayi	nuclear receptor NHR-88	0.0029	0.0307	0.0182
Echinococcus multilocularis	dna polymerase kappa	0.0087	0.2596	0.3782
Loa Loa (eye worm)	hypothetical protein	0.004	0.0747	0.0628
Schistosoma mansoni	hypothetical protein	0.0037	0.0613	0.0316
Schistosoma mansoni	hypothetical protein	0.0183	0.6362	0.6246
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0307	0.0182
Trypanosoma brucei	squalene synthase, putative	0.0252	0.91	1
Brugia malayi	Steroid receptor seven-up type 2	0.0029	0.0307	0.0182
Entamoeba histolytica	hypothetical protein	0.0036	0.0592	0.6387
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0029	0.0307	0.0182
Brugia malayi	hypothetical protein	0.0036	0.0592	0.0471
Schistosoma mansoni	glutaminase	0.0275	1	1
Trypanosoma brucei	DNA polymerase kappa, putative	0.0035	0.0551	0.0606
Echinococcus granulosus	Squalene phytoene synthase	0.0079	0.2262	0.323
Trypanosoma cruzi	phytoene synthase, putative	0.0079	0.2262	0.2163
Plasmodium vivax	fructose 1,6-bisphosphate aldolase, putative	0.0091	0.2766	1
Onchocerca volvulus		0.0029	0.0311	0.0024
Loa Loa (eye worm)	hypothetical protein	0.0082	0.2403	0.2306
Loa Loa (eye worm)	hypothetical protein	0.004	0.0747	0.0628
Trypanosoma cruzi	fructose-bisphosphate aldolase, glycosomal, putative	0.0091	0.2766	0.2741
Loa Loa (eye worm)	fructose-bisphosphate aldolase 2	0.0091	0.2766	0.2674
Brugia malayi	Nuclear hormone receptor-like 1	0.0029	0.0307	0.0182
Echinococcus granulosus	jun protein	0.0085	0.2494	0.3613
Brugia malayi	latrophilin 2 splice variant baaae	0.0037	0.0613	0.0493
Trypanosoma brucei	DNA polymerase kappa, putative	0.0087	0.2596	0.2853
Trypanosoma brucei	DNA polymerase kappa, putative	0.0087	0.2596	0.2853
Echinococcus multilocularis	dna polymerase eta	0.0031	0.0375	0.0113
Mycobacterium tuberculosis	Conserved protein	0.004	0.0747	0.0418
Leishmania major	DNA polymerase kappa, putative	0.0045	0.0926	0.0632
Brugia malayi	intermediate filament protein	0.0029	0.0311	0.0187
Brugia malayi	follicle stimulating hormone receptor	0.025	0.9001	0.8988
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0036	0.0592	0.0471
Echinococcus multilocularis	fructose 1,6 bisphosphate aldolase	0.0091	0.2766	0.4063
Echinococcus granulosus	Basic leucine zipper bZIP transcription factor	0.0085	0.2494	0.3613
Echinococcus granulosus	terminal deoxycytidyl transferase rev1	0.0031	0.0375	0.0113
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0029	0.0307	0.0182
Plasmodium falciparum	fructose-bisphosphate aldolase	0.0091	0.2766	1
Mycobacterium ulcerans	DNA polymerase IV	0.0087	0.2596	0.1999
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0029	0.0307	0.0182
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0029	0.0307	0.0182
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0307	0.0182
Brugia malayi	ecdysteroid receptor	0.0029	0.0307	0.0182
Trypanosoma brucei	DNA polymerase kappa, putative	0.0087	0.2596	0.2853
Brugia malayi	ImpB/MucB/SamB family protein	0.0031	0.0375	0.0252
Schistosoma mansoni	transcription factor LCR-F1	0.0036	0.0592	0.0294
Toxoplasma gondii	fructose-1,6-bisphosphate aldolase	0.0091	0.2766	1
Schistosoma mansoni	fructose 16-bisphosphate aldolase	0.0091	0.2766	0.2538
Plasmodium vivax	histone acetyltransferase GCN5, putative	0.0043	0.0855	0.0538
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.025	0.9001	0.8988
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0029	0.0307	0.0182
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0029	0.0307	0.0182
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0029	0.0307	0.0182
Entamoeba histolytica	hypothetical protein	0.0036	0.0592	0.6387
Leishmania major	fructose-1,6-bisphosphate aldolase	0.0091	0.2766	0.2741
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0029	0.0307	0.0182
Trypanosoma cruzi	fructose-bisphosphate aldolase, glycosomal, putative	0.0091	0.2766	0.2741
Entamoeba histolytica	acetyltransferase, GNAT family	0.0039	0.0715	1
Schistosoma mansoni	hypothetical protein	0.0069	0.1871	0.1614
Toxoplasma gondii	histone lysine acetyltransferase GCN5-A	0.0043	0.0855	0.2853
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0029	0.0307	0.0182
Loa Loa (eye worm)	hypothetical protein	0.0066	0.1763	0.1657
Loa Loa (eye worm)	glutaminase	0.0275	1	1
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0087	0.2596	0.2546
Schistosoma mansoni	terminal deoxycytidyl transferase	0.0031	0.0375	0.0071
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0029	0.0307	0.0182
Giardia lamblia	DINP protein human, muc B family	0.0045	0.0926	1
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0307	0.0182
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0043	0.0855	0.0117
Loa Loa (eye worm)	hypothetical protein	0.004	0.0747	0.0628
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0029	0.0311	0.0187
Loa Loa (eye worm)	hypothetical protein	0.004	0.0747	0.0628
Echinococcus granulosus	histone acetyltransferase KAT2B	0.0142	0.4749	0.7337
Loa Loa (eye worm)	hypothetical protein	0.0029	0.029	0.0166
Onchocerca volvulus		0.0029	0.0311	0.0024
Mycobacterium ulcerans	glutaminase	0.0275	1	1
Echinococcus multilocularis	beta LACTamase domain containing family member	0.004	0.0747	0.0727
Trypanosoma brucei	DNA polymerase kappa, putative	0.0045	0.0926	0.1018
Loa Loa (eye worm)	hypothetical protein	0.0054	0.1283	0.1171
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0029	0.0307	0.0182
Trypanosoma brucei	DNA polymerase kappa, putative	0.0087	0.2596	0.2853
Loa Loa (eye worm)	glutaminase 2	0.0275	1	1
Mycobacterium tuberculosis	Probable lipase LipE	0.004	0.0747	0.0418
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.004	0.0747	0.0454
Mycobacterium tuberculosis	Probable esterase LipL	0.004	0.0747	0.0418
Schistosoma mansoni	jun-related protein	0.0069	0.1871	0.1614
Trypanosoma brucei	DNA polymerase IV, putative	0.0087	0.2596	0.2853
Loa Loa (eye worm)	ImpB/MucB/SamB family protein	0.0031	0.0375	0.0252
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0029	0.0307	0.0182
Onchocerca volvulus		0.004	0.0747	0.2251
Trypanosoma cruzi	squalene synthase, putative	0.0252	0.91	1
Echinococcus granulosus	geminin	0.0183	0.6362	1
Loa Loa (eye worm)	fructose-bisphosphate aldolase 1	0.0091	0.2766	0.2674
Trypanosoma brucei	DNA polymerase kappa, putative	0.0066	0.1763	0.1937
Loa Loa (eye worm)	acetyltransferase	0.0146	0.491	0.4845
Mycobacterium leprae	conserved hypothetical protein	0.004	0.0747	0.5
Mycobacterium tuberculosis	Probable esterase/lipase LipP	0.004	0.0747	0.0418
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0087	0.2596	0.2546
Schistosoma mansoni	lamin	0.0029	0.0311	0.0005
Leishmania major	hypothetical protein, conserved	0.004	0.0747	0.0426
Brugia malayi	nuclear hormone receptor	0.0029	0.0307	0.0182
Schistosoma mansoni	DNA polymerase eta	0.0031	0.0375	0.0071
Loa Loa (eye worm)	hypothetical protein	0.004	0.0747	0.0628
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0307	0.0182
Loa Loa (eye worm)	intermediate filament protein	0.0029	0.0311	0.0187
Trichomonas vaginalis	glutaminase, putative	0.0275	1	1
Mycobacterium tuberculosis	Conserved protein	0.004	0.0747	0.0418
Brugia malayi	beta-lactamase	0.004	0.0747	0.0628
Echinococcus granulosus	fructose 16 bisphosphate aldolase	0.0091	0.2766	0.4063
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0307	0.0182
Echinococcus granulosus	dna polymerase kappa	0.0087	0.2596	0.3782
Trypanosoma brucei	unspecified product	0.0073	0.2045	0.2248
Echinococcus multilocularis	geminin	0.0183	0.6362	1
Trypanosoma cruzi	DNA polymerase kappa, putative	0.0087	0.2596	0.2546
Echinococcus multilocularis	fructose 1,6 bisphosphate aldolase	0.0091	0.2766	0.4063
Schistosoma mansoni	hypothetical protein	0.0079	0.2262	0.2018
Brugia malayi	ImpB/MucB/SamB family protein	0.0031	0.0375	0.0252
Loa Loa (eye worm)	hypothetical protein	0.004	0.0747	0.0628
Entamoeba histolytica	hypothetical protein	0.0036	0.0592	0.6387
Echinococcus multilocularis	musashi	0.0029	0.0311	0.0008
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0029	0.0307	0.0182
Toxoplasma gondii	fructose-bisphosphate aldolase, putative	0.0091	0.2766	1
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0054	0.1283	0.1171
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0036	0.0592	0.0471
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0307	0.0182
Brugia malayi	photoreceptor-specific nuclear receptor	0.0029	0.0307	0.0182
Echinococcus multilocularis	lamin	0.0029	0.0311	0.0008
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0375	0.0252
Echinococcus multilocularis	gcn5proteinral control of amino acid synthesis	0.0146	0.491	0.7603
Trypanosoma brucei	DNA polymerase kappa, putative	0.0087	0.2596	0.2853
Mycobacterium tuberculosis	Probable phytoene synthase PhyA	0.0079	0.2262	0.2123
Echinococcus granulosus	beta LACTamase domain containing family member	0.004	0.0747	0.0727
Schistosoma mansoni	hypothetical protein	0.0036	0.0592	0.0294
Mycobacterium tuberculosis	Conserved protein	0.004	0.0747	0.0418
Onchocerca volvulus	NADH dehydrogenase (ubiquinone) complex I, assembly factor 6 homolog	0.0079	0.2262	1
Echinococcus multilocularis	Squalene phytoene synthase	0.0079	0.2262	0.323
Mycobacterium leprae	Probable lipase LipE	0.004	0.0747	0.5
Trypanosoma brucei	DNA polymerase kappa, putative	0.0087	0.2596	0.2853
Trypanosoma brucei	DNA polymerase kappa, putative	0.0087	0.2596	0.2853
Trypanosoma brucei	DNA polymerase kappa, putative	0.0035	0.0551	0.0606
Brugia malayi	Intermediate filament tail domain containing protein	0.0029	0.0311	0.0187
Onchocerca volvulus		0.004	0.0747	0.2251
Echinococcus granulosus	fructose 16 bisphosphate aldolase	0.0091	0.2766	0.4063
Mycobacterium tuberculosis	Possible conserved lipoprotein LpqK	0.004	0.0747	0.0418
Echinococcus multilocularis	jun protein	0.0085	0.2494	0.3613
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0054	0.1283	0.1171
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0029	0.0307	0.0182
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0029	0.0307	0.0182
Brugia malayi	bZIP transcription factor family protein	0.0085	0.2494	0.2398
Schistosoma mansoni	gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2	0.0146	0.491	0.4749
Leishmania major	squalene synthase, putative	0.0252	0.91	1
Echinococcus granulosus	intermediate filament protein	0.0029	0.0311	0.0008
Loa Loa (eye worm)	hypothetical protein	0.0029	0.0307	0.0182

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (functional)	= 0.054 ug ml-1	Growth inhibition of A 549 cell line by MTT reduction for 3 days of incubation time	ChEMBL.	8496904
IC50 (functional)	= 0.05400000000000001 ug ml-1	Growth inhibition of A 549 cell line by MTT reduction for 3 days of incubation time	ChEMBL.	8496904
IC50 (functional)	= 0.13 ug ml-1	Growth inhibition of HT 29 cell line by MTT reduction for 3 days of incubation time	ChEMBL.	8496904
IC50 (functional)	= 0.13 ug ml-1	Growth inhibition of HT 29 cell line by MTT reduction for 3 days of incubation time	ChEMBL.	8496904
IC50 (functional)	= 0.15 ug ml-1	Growth inhibition of L1210 murine leukemia cells after 1 h exposure in stem cell assay	ChEMBL.	8496904
IC50 (functional)	= 0.15 ug ml-1	Growth inhibition of L1210 murine leukemia cells after 1 h exposure in stem cell assay	ChEMBL.	8496904
IC50 (functional)	= 0.21 ug ml-1	Growth inhibition of L1210 murine leukemia cells after 1 h exposure in untreated control culture	ChEMBL.	8496904
IC50 (functional)	= 0.21 ug ml-1	Growth inhibition of L1210 murine leukemia cells after 1 h exposure in untreated control culture	ChEMBL.	8496904

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Mus musculus	ChEMBL23	8496904
Homo sapiens	ChEMBL23	8496904

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

No external resources registered for this compound

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 38246