TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 164.201 | Formula: C10H12O2
H donors: 0 H acceptors: 2 LogP: 0.28 Rotable bonds: 0
Rule of 5 violations (Lipinski): 1
SMILES: O=C1C[C@]2([C@]3(C1C3C(=O)C2)C)C
InChi: 1S/C10H12O2/c1-9-3-5(11)7-8(6(12)4-9)10(7,9)2/h7-8H,3-4H2,1-2H3/t7?,8?,9-,10+
InChiKey: ULHYKDOPGVYDCC-OXYCZDQYSA-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

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	microtubule-associated protein tau	0.0715	0.2194	0.6884
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0036	0.0066	0.0439
Echinococcus multilocularis	tumor protein p63	0.0727	0.2231	0.7001
Schistosoma mansoni	hypothetical protein	0.0052	0.0115	0.0359
Loa Loa (eye worm)	hypothetical protein	0.0491	0.1492	0.1492
Loa Loa (eye worm)	hypothetical protein	0.011	0.0297	0.0297
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.0495	0.1504	1
Plasmodium vivax	ataxin-2 like protein, putative	0.0026	0.0035	0.1783
Onchocerca volvulus		0.1151	0.3558	1
Mycobacterium ulcerans	long-chain fatty-acid CoA ligase	0.0051	0.0113	0.5766
Echinococcus multilocularis	Niemann Pick C1 protein	0.0157	0.0445	0.1396
Echinococcus multilocularis	atpase aaa+ type core atpase aaa type core	0.0905	0.2787	0.8745
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0035	0.0035
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0051	0.0113	0.5766
Loa Loa (eye worm)	hypothetical protein	0.0491	0.1492	0.1492
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0051	0.0113	0.38
Echinococcus multilocularis	Niemann Pick C1 protein	0.011	0.0297	0.0932
Echinococcus multilocularis	microtubule associated protein 2	0.0715	0.2194	0.6884
Brugia malayi	hypothetical protein	0.0491	0.1492	0.1492
Loa Loa (eye worm)	hypothetical protein	0.0111	0.0302	0.0302
Brugia malayi	Cytochrome P450 family protein	0.0024	0.0027	0.0027
Echinococcus granulosus	Niemann Pick C1 protein	0.0157	0.0445	0.1396
Plasmodium vivax	acyl-CoA synthetase, putative	0.0038	0.0073	0.3703
Brugia malayi	latrophilin 2 splice variant baaae	0.0111	0.0302	0.0302
Loa Loa (eye worm)	hypothetical protein	0.0123	0.0339	0.0339
Entamoeba histolytica	Niemann-Pick C1 protein, putative	0.011	0.0297	1
Mycobacterium leprae	Probable lipase LipE	0.0077	0.0196	1
Leishmania major	4-coumarate:coa ligase-like protein	0.0051	0.0113	0.5766
Schistosoma mansoni	hypothetical protein	0.0052	0.0115	0.0359
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0051	0.0113	0.0354
Brugia malayi	LBP / BPI / CETP family, N-terminal domain containing protein	0.1151	0.3558	0.3558
Schistosoma mansoni	serine/threonine protein kinase	0.0068	0.0167	0.0522
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0052	0.0115	0.0359
Loa Loa (eye worm)	LBP/BPI/CETP family domain-containing protein	0.066	0.202	0.202
Mycobacterium tuberculosis	Conserved protein	0.0077	0.0196	0.1302
Loa Loa (eye worm)	hypothetical protein	0.0077	0.0196	0.0196
Onchocerca volvulus		0.0054	0.0122	0.0342
Trypanosoma cruzi	PAB1-binding protein , putative	0.0026	0.0035	0.1783
Entamoeba histolytica	hypothetical protein	0.004	0.0079	0.2652
Mycobacterium ulcerans	long-chain-fatty-acid--CoA ligase	0.0051	0.0113	0.5766
Mycobacterium tuberculosis	Probable lipase LipD	0.0077	0.0196	0.1302
Plasmodium falciparum	ataxin-2 like protein, putative	0.0026	0.0035	0.4816
Echinococcus granulosus	Niemann Pick C1 protein	0.011	0.0297	0.0932
Loa Loa (eye worm)	beta-lactamase	0.0077	0.0196	0.0196
Schistosoma mansoni	hypothetical protein	0.0045	0.0095	0.0299
Trichomonas vaginalis	conserved hypothetical protein	0.0047	0.0101	0.0675
Echinococcus granulosus	expressed conserved protein	0.0103	0.0276	0.0867
Onchocerca volvulus		0.0077	0.0196	0.055
Loa Loa (eye worm)	hypothetical protein	0.0491	0.1492	0.1492
Trichomonas vaginalis	penicillin-binding protein, putative	0.0077	0.0196	0.1313
Loa Loa (eye worm)	hypothetical protein	0.066	0.202	0.202
Brugia malayi	beta-lactamase family protein	0.0077	0.0196	0.0196
Mycobacterium tuberculosis	Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase)	0.0051	0.0113	0.0751
Loa Loa (eye worm)	cytochrome P450 family protein	0.0024	0.0027	0.0027
Plasmodium vivax	hypothetical protein, conserved	0.0077	0.0196	1
Plasmodium falciparum	ataxin-2 like protein, putative	0.0026	0.0035	0.4816
Brugia malayi	LBP/BPI	0.0491	0.1492	0.1492
Echinococcus granulosus	microtubule associated protein 2	0.0715	0.2194	0.6884
Mycobacterium tuberculosis	Possible conserved lipoprotein LpqK	0.0077	0.0196	0.1302
Loa Loa (eye worm)	hypothetical protein	0.066	0.202	0.202
Loa Loa (eye worm)	hypothetical protein	0.1151	0.3558	0.3558
Mycobacterium ulcerans	lipase LipD	0.0077	0.0196	1
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0051	0.0113	0.0354
Loa Loa (eye worm)	hypothetical protein	0.066	0.202	0.202
Brugia malayi	Temporarily assigned gene name protein 59	0.0133	0.0371	0.0371
Onchocerca volvulus		0.0051	0.0113	0.0317
Schistosoma mansoni	hypothetical protein	0.0111	0.0302	0.0947
Onchocerca volvulus		0.0077	0.0196	0.055
Echinococcus multilocularis	protein patched	0.0047	0.0101	0.0316
Mycobacterium ulcerans	esterase/lipase LipP	0.0077	0.0196	1
Onchocerca volvulus		0.1151	0.3558	1
Onchocerca volvulus		0.066	0.202	0.5676
Onchocerca volvulus		0.0491	0.1492	0.4192
Leishmania major	hypothetical protein, conserved	0.0026	0.0035	0.1783
Onchocerca volvulus		0.1032	0.3187	0.8957
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0051	0.0113	0.0113
Onchocerca volvulus		0.1151	0.3558	1
Loa Loa (eye worm)	hypothetical protein	0.0077	0.0196	0.0196
Brugia malayi	beta-lactamase family protein	0.0077	0.0196	0.0196
Schistosoma mansoni	survival motor neuron protein	0.0054	0.0122	0.0382
Mycobacterium ulcerans	acyl-CoA synthetase	0.0051	0.0113	0.5766
Toxoplasma gondii	ABC1 family protein	0.0077	0.0196	1
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0073	0.0073
Plasmodium falciparum	acyl-CoA synthetase	0.0038	0.0073	1
Schistosoma mansoni	niemann-pick C1 (NPC1)	0.0112	0.0303	0.0949
Brugia malayi	LBP / BPI / CETP family, C-terminal domain containing protein	0.1151	0.3558	0.3558
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0051	0.0113	0.5766
Onchocerca volvulus		0.1151	0.3558	1
Onchocerca volvulus		0.1151	0.3558	1
Echinococcus multilocularis	sterol regulatory element binding protein	0.0047	0.0101	0.0316
Trypanosoma brucei	PAB1-binding protein , putative	0.0026	0.0035	0.1783
Echinococcus multilocularis	serine:threonine protein kinase MRCK beta	0.0068	0.0167	0.0522
Mycobacterium tuberculosis	Probable hydrolase	0.0077	0.0196	0.1302
Mycobacterium leprae	PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE)	0.0051	0.0113	0.5766
Entamoeba histolytica	hypothetical protein	0.004	0.0079	0.2652
Mycobacterium ulcerans	fatty-acid-CoA ligase	0.0038	0.0073	0.3703
Entamoeba histolytica	hypothetical protein	0.004	0.0079	0.2652
Schistosoma mansoni	hypothetical protein	0.0045	0.0095	0.0299
Trypanosoma brucei	hypothetical protein, conserved	0.0077	0.0196	1
Brugia malayi	LBP / BPI / CETP family, C-terminal domain containing protein	0.066	0.202	0.202
Brugia malayi	CHE-14 protein	0.0047	0.0101	0.0101
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0051	0.0113	0.38
Leishmania major	4-coumarate:coa ligase-like protein	0.0051	0.0113	0.5766
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0036	0.0066	0.0439
Echinococcus granulosus	survival motor neuron protein 1	0.0264	0.078	0.2446
Onchocerca volvulus		0.103	0.318	0.8937
Brugia malayi	AMP-binding enzyme family protein	0.0051	0.0113	0.0113
Loa Loa (eye worm)	LBP/BPI/CETP family domain-containing protein	0.1151	0.3558	0.3558
Brugia malayi	hypothetical protein	0.066	0.202	0.202
Schistosoma mansoni	hypothetical protein	0.004	0.0079	0.0247
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0052	0.0115	0.0359
Schistosoma mansoni	hypothetical protein	0.0054	0.0122	0.0382
Brugia malayi	hypothetical protein	0.0264	0.078	0.078
Mycobacterium ulcerans	beta-lactamase	0.0077	0.0196	1
Echinococcus granulosus	tumor protein p63	0.0727	0.2231	0.7001
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0051	0.0113	0.0354
Mycobacterium tuberculosis	Conserved protein	0.0077	0.0196	0.1302
Mycobacterium ulcerans	hypothetical protein	0.0077	0.0196	1
Brugia malayi	LBP / BPI / CETP family, C-terminal domain containing protein	0.066	0.202	0.202
Echinococcus multilocularis	GPCR, family 2	0.0052	0.0115	0.0359
Brugia malayi	AMP-binding enzyme family protein	0.0051	0.0113	0.0113
Chlamydia trachomatis	acylglycerophosphoethanolamine acyltransferase	0.0038	0.0073	0.5
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0163	0.0463	0.0463
Trichomonas vaginalis	penicillin-binding protein, putative	0.0077	0.0196	0.1313
Echinococcus granulosus	beta LACTamase domain containing family member	0.0077	0.0196	0.0614
Schistosoma mansoni	hypothetical protein	0.0052	0.0115	0.0359
Loa Loa (eye worm)	hypothetical protein	0.066	0.202	0.202
Schistosoma mansoni	serine/threonine protein kinase	0.0068	0.0167	0.0522
Mycobacterium ulcerans	long-chain-fatty-acid-CoA ligase	0.0051	0.0113	0.5766
Mycobacterium leprae	conserved hypothetical protein	0.0077	0.0196	1
Mycobacterium ulcerans	acyl-CoA synthetase	0.0051	0.0113	0.5766
Mycobacterium tuberculosis	Probable lipase LipE	0.0077	0.0196	0.1302
Echinococcus multilocularis	protein dispatched 1	0.0054	0.0122	0.0382
Onchocerca volvulus		0.1151	0.3558	1
Brugia malayi	hypothetical protein	0.004	0.0079	0.0079
Echinococcus granulosus	sterol regulatory element binding protein	0.0047	0.0101	0.0316
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0077	0.0196	0.0614
Loa Loa (eye worm)	hypothetical protein	0.0077	0.0196	0.0196
Loa Loa (eye worm)	hypothetical protein	0.0491	0.1492	0.1492
Brugia malayi	AMP-binding enzyme family protein	0.0051	0.0113	0.0113
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0051	0.0113	0.0751
Loa Loa (eye worm)	hypothetical protein	0.0058	0.0134	0.0134
Onchocerca volvulus		0.1151	0.3558	1
Loa Loa (eye worm)	hypothetical protein	0.0047	0.0101	0.0101
Trichomonas vaginalis	D-aminoacylase, putative	0.0077	0.0196	0.1313
Mycobacterium tuberculosis	Probable esterase LipL	0.0077	0.0196	0.1302
Brugia malayi	Protein kinase domain containing protein	0.013	0.036	0.036
Mycobacterium tuberculosis	Conserved protein	0.0077	0.0196	0.1302
Onchocerca volvulus		0.1151	0.3558	1
Mycobacterium tuberculosis	Probable esterase/lipase LipP	0.0077	0.0196	0.1302
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.004	0.0079	0.0247
Trichomonas vaginalis	esterase, putative	0.0077	0.0196	0.1313
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0051	0.0113	0.0354
Echinococcus granulosus	Serine/threonine-protein kinase Genghis Khan	0.0068	0.0167	0.0522
Loa Loa (eye worm)	hypothetical protein	0.0077	0.0196	0.0196
Brugia malayi	hypothetical protein	0.066	0.202	0.202
Echinococcus multilocularis	rho associated protein kinase	0.1032	0.3187	1
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0077	0.0196	0.0196
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0073	0.0073
Onchocerca volvulus		0.066	0.202	0.5676
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0077	0.0196	0.0614
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0163	0.0463	0.0463
Mycobacterium ulcerans	hypothetical protein	0.0051	0.0113	0.5766
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0051	0.0113	0.0354
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0073	0.0073
Schistosoma mansoni	patched 1	0.0047	0.0101	0.0316
Echinococcus multilocularis	expressed conserved protein	0.0103	0.0276	0.0867
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0051	0.0113	0.0354
Mycobacterium tuberculosis	Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase)	0.0038	0.0073	0.0482
Loa Loa (eye worm)	abnormal chemotaxis protein 14	0.0047	0.0101	0.0101
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0052	0.0115	0.0359
Trichomonas vaginalis	D-aminoacylase, putative	0.0077	0.0196	0.1313
Echinococcus granulosus	Protein patched homolog 1	0.0047	0.0101	0.0316
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0052	0.0115	0.0115
Trichomonas vaginalis	D-aminoacylase, putative	0.0077	0.0196	0.1313
Loa Loa (eye worm)	hypothetical protein	0.0077	0.0196	0.0196
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0036	0.0066	0.0439
Brugia malayi	Iron-sulfur cluster assembly accessory protein	0.0054	0.0122	0.0122
Schistosoma mansoni	hypothetical protein	0.0052	0.0115	0.0359
Brugia malayi	Niemann-Pick C1 protein precursor	0.011	0.0297	0.0297
Brugia malayi	LBP / BPI / CETP family, C-terminal domain containing protein	0.066	0.202	0.202
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0113	0.0113
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0051	0.0113	0.0113
Loa Loa (eye worm)	hypothetical protein	0.0077	0.0196	0.0196
Loa Loa (eye worm)	LBP/BPI/CETP family domain-containing protein	0.066	0.202	0.202
Schistosoma mansoni	transcription factor LCR-F1	0.004	0.0079	0.0247
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0113	0.0113
Brugia malayi	beta-lactamase	0.0077	0.0196	0.0196
Schistosoma mansoni	hypothetical protein	0.0045	0.0095	0.0299
Schistosoma mansoni	serine/threonine protein kinase	0.1032	0.3187	1
Echinococcus granulosus	GPCR family 2	0.0052	0.0115	0.0359
Loa Loa (eye worm)	hypothetical protein	0.0264	0.078	0.078
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0077	0.0196	0.0196
Loa Loa (eye worm)	hypothetical protein	0.0106	0.0287	0.0287
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0051	0.0113	0.0354
Loa Loa (eye worm)	hypothetical protein	0.0163	0.0463	0.0463
Loa Loa (eye worm)	hypothetical protein	0.0052	0.0115	0.0115
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0073	0.0073
Echinococcus multilocularis	survival motor neuron protein 1	0.0264	0.078	0.2446
Entamoeba histolytica	hypothetical protein	0.004	0.0079	0.2652
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0163	0.0463	0.0463
Schistosoma mansoni	cellular tumor antigen P53	0.0106	0.0287	0.0899
Onchocerca volvulus		0.0077	0.0196	0.055
Brugia malayi	Latrophilin receptor protein 2	0.0052	0.0115	0.0115
Mycobacterium tuberculosis	Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase)	0.0036	0.0066	0.0439
Trypanosoma cruzi	PAB1-binding protein , putative	0.0026	0.0035	0.1783
Trypanosoma cruzi	hypothetical protein, conserved	0.0077	0.0196	1
Mycobacterium ulcerans	acyl-CoA synthetase	0.0051	0.0113	0.5766
Loa Loa (eye worm)	hypothetical protein	0.066	0.202	0.202
Toxoplasma gondii	LsmAD domain-containing protein	0.0026	0.0035	0.1783
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0052	0.0115	0.0115
Loa Loa (eye worm)	AGC/DMPK/GEK protein kinase	0.0192	0.0555	0.0555
Leishmania major	4-coumarate:coa ligase-like protein	0.0051	0.0113	0.5766
Brugia malayi	hypothetical protein	0.0026	0.0035	0.0035
Brugia malayi	LBP / BPI / CETP family, N-terminal domain containing protein	0.1151	0.3558	0.3558
Leishmania major	hypothetical protein, conserved	0.0077	0.0196	1
Loa Loa (eye worm)	hypothetical protein	0.0038	0.0073	0.0073
Brugia malayi	hypothetical protein	0.0017	0.0006	0.0006
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.004	0.0079	0.0247
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0077	0.0196	0.0614
Echinococcus granulosus	rho-associated protein kinase 1	0.1032	0.3187	1
Loa Loa (eye worm)	hypothetical protein	0.0051	0.0113	0.0113
Mycobacterium tuberculosis	Probable conserved lipoprotein	0.0077	0.0196	0.1302
Entamoeba histolytica	acyl-coA synthetase, putative	0.0051	0.0113	0.38
Trypanosoma cruzi	hypothetical protein, conserved	0.0077	0.0196	1
Mycobacterium ulcerans	fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE	0.0077	0.0196	1
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0052	0.0115	0.0359
Trichomonas vaginalis	conserved hypothetical protein	0.0491	0.1492	1
Schistosoma mansoni	hypothetical protein	0.0045	0.0095	0.0299
Onchocerca volvulus		0.0106	0.0287	0.0805

Activities

Activity type	Activity value	Assay description	Source	Reference
GI50 (functional)	-4.689	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the MALME-3M Melanoma cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-4	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the MDA-N Breast cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-4	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SN12C Renal cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-4	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the NCI-H23 Non-Small Cell Lung cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-4	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the UO-31 Renal cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-4	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the ACHN Renal cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-4	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the DU-145 Prostate cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-4	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SF-539 Central Nervous System cell line. (Class of assay: confirmatory)	ChEMBL.	No reference
GI50 (functional)	-4	PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SK-MEL-5 Melanoma cell line. (Class of assay: confirmatory)	ChEMBL.	No reference

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: CHEMBL1982986

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1615609