TDR Targets

Basic information

Technical information

TDR Targets ID: 1331215
Name: 2-(cyclohexylmethyl-(phenylmethyl)amino)ethan ol
MW: 247.376 | Formula: C16H25NO
H donors: 1 H acceptors: 1 LogP: 3.44 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: OCCN(Cc1ccccc1)CC1CCCCC1
InChi: 1S/C16H25NO/c18-12-11-17(13-15-7-3-1-4-8-15)14-16-9-5-2-6-10-16/h1,3-4,7-8,16,18H,2,5-6,9-14H2
InChiKey: RZWUHDHJWWDPDK-UHFFFAOYSA-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

2-(benzyl-(cyclohexylmethyl)amino)ethanol
MLS000059204
SMR000069668
2-[benzyl(cyclohexylmethyl)amino]ethanol
Oprea1_169875

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	GNAS complex locus	Starlite/ChEMBL	No references
Homo sapiens	euchromatic histone-lysine N-methyltransferase 2	Starlite/ChEMBL	No references
Homo sapiens	TAR DNA binding protein	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Schistosoma japonicum	ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative	Get druggable targets OG5_131088	All targets in OG5_131088
Echinococcus multilocularis	tar DNA binding protein	Get druggable targets OG5_132461	All targets in OG5_132461
Brugia malayi	Pre-SET motif family protein	Get druggable targets OG5_131470	All targets in OG5_131470
Schistosoma mansoni	tar DNA-binding protein	Get druggable targets OG5_132461	All targets in OG5_132461
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	Get druggable targets OG5_131088	All targets in OG5_131088
Brugia malayi	RNA binding protein	Get druggable targets OG5_132461	All targets in OG5_132461
Schistosoma japonicum	TAR DNA-binding protein 43, putative	Get druggable targets OG5_132461	All targets in OG5_132461
Loa Loa (eye worm)	TAR-binding protein	Get druggable targets OG5_132461	All targets in OG5_132461
Schistosoma mansoni	tar DNA-binding protein	Get druggable targets OG5_132461	All targets in OG5_132461
Echinococcus granulosus	tar DNA binding protein	Get druggable targets OG5_132461	All targets in OG5_132461
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088
Onchocerca volvulus		Get druggable targets OG5_131470	All targets in OG5_131470
Brugia malayi	TAR-binding protein	Get druggable targets OG5_132461	All targets in OG5_132461
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	Get druggable targets OG5_131470	All targets in OG5_131470
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Loa Loa (eye worm)	RNA binding protein	Get druggable targets OG5_132461	All targets in OG5_132461
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	Get druggable targets OG5_131088	All targets in OG5_131088
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	Get druggable targets OG5_132461	All targets in OG5_132461
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma mansoni	tar DNA-binding protein	Get druggable targets OG5_132461	All targets in OG5_132461
Schistosoma mansoni	tar DNA-binding protein	Get druggable targets OG5_132461	All targets in OG5_132461
Brugia malayi	RNA recognition motif domain containing protein	Get druggable targets OG5_132461	All targets in OG5_132461
Schistosoma mansoni	tar DNA-binding protein	Get druggable targets OG5_132461	All targets in OG5_132461
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Schistosoma japonicum	TAR DNA-binding protein 43, putative	Get druggable targets OG5_132461	All targets in OG5_132461
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	Get druggable targets OG5_131088	All targets in OG5_131088
Trichomonas vaginalis	set domain proteins, putative	Get druggable targets OG5_131470	All targets in OG5_131470

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Schistosoma mansoni	GTP-binding protein alpha subunit gna	GNAS complex locus	394 aa	450 aa	28.7 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Brugia malayi	ImpB/MucB/SamB family protein	0.002	0.0429	0.0403
Mycobacterium tuberculosis	Probable cytochrome P450 139 Cyp139	0.001	0.0111	0.0188
Toxoplasma gondii	histone lysine acetyltransferase GCN5-B	0.0086	0.2763	1
Trichomonas vaginalis	Clan SC, family S33, methylesterase-like serine peptidase	0.0136	0.4475	0.4589
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.001	0.0105	0.0078
Mycobacterium tuberculosis	Probable aldehyde dehydrogenase	0.0059	0.1793	0.3971
Loa Loa (eye worm)	ImpB/MucB/SamB family protein	0.002	0.0429	0.0403
Mycobacterium ulcerans	cytochrome P450 142A3 Cyp142A3	0.001	0.0111	0.0089
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.001	0.0105	0.0078
Echinococcus multilocularis	FTZ F1 alpha	0.001	0.0105	0.0078
Echinococcus granulosus	TGF beta signal transducer SmadC	0.0009	0.0047	0.002
Brugia malayi	Cytochrome P450 family protein	0.0019	0.041	0.0384
Brugia malayi	Cytochrome P450 family protein	0.001	0.0111	0.0084
Leishmania major	aldehyde dehydrogenase, mitochondrial precursor	0.0059	0.1793	0.3971
Leishmania major	cytochrome p450-like protein	0.0019	0.041	0.0861
Schistosoma mansoni	tar DNA-binding protein	0.0076	0.2415	0.2394
Brugia malayi	Steroid receptor seven-up type 2	0.001	0.0105	0.0078
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.0429	0.0904
Echinococcus multilocularis	gcn5proteinral control of amino acid synthesis	0.0294	1	1
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.001	0.0105	0.0078
Echinococcus granulosus	histone acetyltransferase KAT2B	0.0286	0.9713	1
Trichomonas vaginalis	histone acetyltransferase gcn5, putative	0.0008	0.0036	0.0009
Schistosoma mansoni	steroid hormone receptor ad4bp	0.001	0.0105	0.0078
Plasmodium vivax	PST-A protein	0.0008	0.0027	0.0061
Mycobacterium ulcerans	cytochrome P450 188A3 Cyp188A3	0.001	0.0111	0.0089
Trichomonas vaginalis	valacyclovir hydrolase, putative	0.0136	0.4475	0.4589
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.001	0.0105	0.008
Schistosoma mansoni	hypothetical protein	0.001	0.0111	0.0084
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.0429	0.0904
Trichomonas vaginalis	cat eye syndrome critical region protein 2, cscr2, putative	0.0086	0.2763	0.2823
Echinococcus granulosus	FTZ F1 alpha	0.001	0.0105	0.008
Loa Loa (eye worm)	cytochrome P450 family protein	0.0019	0.041	0.0384
Mycobacterium ulcerans	cytochrome P450 105Q4 Cyp105Q4	0.001	0.0111	0.0089
Echinococcus granulosus	mothers against decapentaplegic 5	0.0009	0.0047	0.002
Schistosoma mansoni	smad	0.0009	0.0047	0.0019
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.001	0.0105	0.0078
Plasmodium vivax	alpha/beta hydrolase, putative	0.0008	0.0027	0.0061
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.001	0.0105	0.0078
Mycobacterium ulcerans	cytochrome P450 123A3 Cyp123A3	0.001	0.0111	0.0089
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.0429	0.0904
Mycobacterium ulcerans	glutaminase	0.0277	0.9389	1
Schistosoma mansoni	thyroid hormone receptor	0.001	0.0105	0.0078
Schistosoma mansoni	nuclear hormone receptor	0.001	0.0105	0.0078
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.001	0.0105	0.0078
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.0429	0.0904
Trypanosoma brucei	DNA polymerase kappa, putative	0.0013	0.0218	0.0429
Trypanosoma cruzi	DNA polymerase eta, putative	0.002	0.0429	0.0904
Mycobacterium tuberculosis	Possible cytochrome P450 126 Cyp126	0.001	0.0111	0.0188
Plasmodium vivax	unspecified product	0.0008	0.0027	0.0061
Entamoeba histolytica	deoxycytidyl transferase, putative	0.002	0.0429	0.096
Plasmodium falciparum	prodrug activation and resistance esterase	0.0008	0.0027	0.0061
Plasmodium vivax	SET domain containing protein	0.0009	0.0046	0.0103
Mycobacterium tuberculosis	Probable cytochrome P450 monooxygenase 142 Cyp142	0.001	0.0111	0.0188
Echinococcus granulosus	cytochrome P450 2K1	0.001	0.0111	0.0086
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.001	0.0105	0.0078
Mycobacterium tuberculosis	Possible cytochrome P450 135A1 Cyp135A1	0.001	0.0111	0.0188
Plasmodium falciparum	alpha/beta hydrolase, putative	0.0008	0.0027	0.0061
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.001	0.0105	0.0078
Schistosoma mansoni	smad1 5 8 and	0.0009	0.0047	0.0019
Leishmania major	cytochrome p450-like protein	0.001	0.0111	0.0188
Plasmodium falciparum	lysophospholipase, putative	0.0136	0.4475	1
Loa Loa (eye worm)	acetyltransferase	0.0294	1	1
Plasmodium vivax	lysophospholipase, putative	0.0008	0.0027	0.0061
Schistosoma mansoni	aldehyde dehydrogenase	0.0059	0.1793	0.1771
Echinococcus granulosus	ecdysone induced protein 78C	0.001	0.0105	0.008
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0055	0.1674	0.17
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.0429	0.0904
Trypanosoma brucei	DNA polymerase kappa, putative	0.0013	0.0218	0.0429
Toxoplasma gondii	hydrolase, alpha/beta fold family protein	0.0008	0.0027	0.0099
Mycobacterium tuberculosis	Probable cytochrome P450 124 Cyp124	0.001	0.0111	0.0188
Trichomonas vaginalis	bromodomain-containing protein, putative	0.0086	0.2763	0.2823
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.001	0.0105	0.0078
Schistosoma mansoni	smad1 5 8 and	0.0009	0.0047	0.0019
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.1674	0.1651
Echinococcus multilocularis	mothers against decapentaplegic 5	0.0009	0.0047	0.0019
Schistosoma mansoni	thyroid hormone receptor	0.001	0.0105	0.0078
Brugia malayi	photoreceptor-specific nuclear receptor	0.001	0.0105	0.0078
Schistosoma mansoni	tar DNA-binding protein	0.0076	0.2415	0.2394
Trypanosoma brucei	unspecified product	0.0013	0.0218	0.0429
Brugia malayi	Cytochrome P450 family protein	0.001	0.0111	0.0084
Mycobacterium tuberculosis	Conserved hypothetical protein	0.002	0.0429	0.0904
Schistosoma mansoni	tar DNA-binding protein	0.0076	0.2415	0.2394
Trichomonas vaginalis	conserved hypothetical protein	0.0136	0.4475	0.4589
Echinococcus multilocularis	tar DNA binding protein	0.0076	0.2415	0.2394
Trypanosoma cruzi	DNA polymerase kappa, putative	0.002	0.0429	0.0904
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.0429	0.0904
Loa Loa (eye worm)	hypothetical protein	0.001	0.0105	0.0078
Toxoplasma gondii	phospholipase	0.0008	0.0027	0.0099
Echinococcus granulosus	smad	0.0009	0.0047	0.002
Trypanosoma cruzi	monoglyceride lipase, putative	0.0136	0.4475	1
Toxoplasma gondii	hypothetical protein	0.0008	0.0027	0.0099
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.0429	0.0904
Brugia malayi	MH1 domain containing protein	0.0009	0.0047	0.0019
Mycobacterium ulcerans	cytochrome P450 51B1 Cyp51B1	0.001	0.0111	0.0089
Entamoeba histolytica	;Alias	0.0008	0.0027	0.0061
Echinococcus granulosus	dna polymerase kappa	0.002	0.0429	0.0415
Mycobacterium tuberculosis	Probable cytochrome P450 140 Cyp140	0.001	0.0111	0.0188
Toxoplasma gondii	histone lysine acetyltransferase GCN5-A	0.0086	0.2763	1
Echinococcus multilocularis	ecdysone induced protein 78C	0.001	0.0105	0.0078
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0055	0.1674	0.1651
Mycobacterium tuberculosis	Probable cytochrome P450 136 Cyp136	0.001	0.0111	0.0188
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.001	0.0105	0.0078
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.001	0.0105	0.0078
Brugia malayi	MH2 domain containing protein	0.0125	0.4118	0.4102
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.001	0.0105	0.0078
Mycobacterium ulcerans	cytochrome P450 136A2 Cyp136A2	0.001	0.0111	0.0089
Trypanosoma brucei	unspecified product	0.0013	0.0218	0.0429
Mycobacterium ulcerans	cytochrome P450 185A4 Cyp185A4	0.0019	0.041	0.0409
Plasmodium falciparum	esterase, putative	0.0008	0.0027	0.0061
Trichomonas vaginalis	DNA polymerase IV / kappa, putative	0.002	0.0429	0.0415
Schistosoma mansoni	coup transcription factor	0.001	0.0105	0.0078
Trypanosoma brucei	Lanosterol 14-alpha demethylase	0.001	0.0111	0.0188
Echinococcus multilocularis		0.001	0.0111	0.0084
Schistosoma mansoni	DNA polymerase eta	0.002	0.0429	0.0403
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.001	0.0105	0.0078
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.001	0.0105	0.0078
Trypanosoma brucei	cytochrome P450, putative	0.0019	0.041	0.0861
Brugia malayi	ImpB/MucB/SamB family protein	0.002	0.0429	0.0403
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.0035	0.0959	0.0962
Mycobacterium tuberculosis	Probable cytochrome P450 123 Cyp123	0.001	0.0111	0.0188
Echinococcus multilocularis	smad	0.0009	0.0047	0.0019
Mycobacterium tuberculosis	Probable cytochrome P450 130 Cyp130	0.001	0.0111	0.0188
Schistosoma mansoni	retinoic acid receptor RXR	0.001	0.0105	0.0078
Loa Loa (eye worm)	Smad1	0.0009	0.0047	0.0019
Trypanosoma cruzi	cytochrome p450-like protein, putative	0.001	0.0111	0.0188
Echinococcus granulosus	terminal deoxycytidyl transferase rev1	0.002	0.0429	0.0415
Plasmodium falciparum	histone acetyltransferase GCN5	0.0079	0.2512	0.5615
Loa Loa (eye worm)	cytochrome P450 family protein	0.001	0.0111	0.0084
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.001	0.0105	0.0078
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.0429	0.0904
Leishmania major	DNA polymerase eta, putative	0.002	0.0429	0.0904
Loa Loa (eye worm)	hypothetical protein	0.0009	0.0048	0.0021
Brugia malayi	steroid hormone receptor	0.001	0.0105	0.0078
Echinococcus granulosus	tar DNA binding protein	0.0076	0.2415	0.2465
Toxoplasma gondii	protein c14orf29, putative	0.0008	0.0027	0.0099
Trypanosoma brucei	DNA polymerase kappa, putative	0.0013	0.0218	0.0429
Loa Loa (eye worm)	hypothetical protein	0.0036	0.1005	0.0981
Mycobacterium ulcerans	lysophospholipase	0.0136	0.4475	0.475
Brugia malayi	RNA binding protein	0.0076	0.2415	0.2394
Loa Loa (eye worm)	MH1 domain-containing protein	0.0009	0.0047	0.0019
Giardia lamblia	Histone acetyltransferase GCN5	0.0079	0.2512	1
Plasmodium falciparum	esterase, putative	0.0008	0.0027	0.0061
Plasmodium vivax	hypothetical protein, conserved	0.0008	0.0027	0.0061
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.001	0.0105	0.008
Loa Loa (eye worm)	hypothetical protein	0.002	0.0429	0.0403
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.001	0.0105	0.0078
Entamoeba histolytica	hypothetical protein	0.0008	0.0027	0.0061
Loa Loa (eye worm)	follicle stimulating hormone receptor	0.0227	0.7653	0.7647
Plasmodium falciparum	exported lipase 1	0.0008	0.0027	0.0061
Trypanosoma cruzi	Lanosterol 14-alpha demethylase	0.001	0.0111	0.0188
Plasmodium falciparum	lysophospholipase, putative	0.0136	0.4475	1
Schistosoma mansoni	RAR-like nuclear receptor	0.001	0.0105	0.0078
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0055	0.1674	0.1651
Loa Loa (eye worm)	MH2 domain-containing protein	0.0125	0.4118	0.4102
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.001	0.0105	0.0078
Brugia malayi	ecdysteroid receptor	0.001	0.0105	0.0078
Mycobacterium ulcerans	cytochrome P450 189A7 Cyp189A7	0.001	0.0111	0.0089
Mycobacterium ulcerans	cytochrome P450 187A4 Cyp187A4	0.001	0.0111	0.0089
Loa Loa (eye worm)	MH2 domain-containing protein	0.0009	0.0047	0.0019
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0055	0.1674	0.17
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.0036	0.1005	0.0981
Plasmodium falciparum	epoxide hydrolase 2	0.0008	0.0027	0.0061
Brugia malayi	Pre-SET motif family protein	0.0036	0.1005	0.0981
Giardia lamblia	DINP protein human, muc B family	0.002	0.0429	0.1618
Loa Loa (eye worm)	CYP4Cod1	0.0019	0.041	0.0384
Mycobacterium tuberculosis	Possible DNA-damage-inducible protein P DinP (DNA polymerase V) (pol IV 2) (DNA nucleotidyltransferase (DNA-directed))	0.002	0.0429	0.0904
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.1674	0.1651
Echinococcus multilocularis	aldehyde dehydrogenase, mitochondrial	0.0059	0.1793	0.1771
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.0036	0.1005	0.3638
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.0036	0.1005	0.0981
Plasmodium falciparum	alpha/beta hydrolase, putative	0.0008	0.0027	0.0061
Schistosoma mansoni	gcn5proteinral control of amino-acid synthesis 5-like 2 gcnl2	0.0294	1	1
Plasmodium vivax	hypothetical protein, conserved	0.0008	0.0027	0.0061
Brugia malayi	Smad1	0.0009	0.0047	0.0019
Mycobacterium tuberculosis	Probable cytochrome P450 125 Cyp125	0.001	0.0111	0.0188
Trypanosoma cruzi	cytochrome P450, putative	0.0019	0.041	0.0861
Trypanosoma brucei	unspecified product	0.002	0.0429	0.0904
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.001	0.0105	0.008
Entamoeba histolytica	hydrolase, alpha/beta fold family domain containing protein	0.0008	0.0027	0.0061
Leishmania major	lanosterol 14-alpha-demethylase, putative	0.001	0.0111	0.0188
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.0429	0.0904
Mycobacterium ulcerans	cytochrome P450 140A5 Cyp140A5	0.001	0.0111	0.0089
Trypanosoma brucei	DNA polymerase IV, putative	0.002	0.0429	0.0904
Leishmania major	DNA polymerase kappa, putative,DNA polymerase IV, putative	0.002	0.0429	0.0904
Plasmodium falciparum	lysophospholipase, putative	0.0008	0.0027	0.0061
Loa Loa (eye worm)	steroid hormone receptor	0.001	0.0105	0.0078
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0251	0.8509	0.8505
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.0036	0.1005	0.0981
Loa Loa (eye worm)	cytochrome P450 family protein	0.0019	0.041	0.0384
Toxoplasma gondii	hypothetical protein	0.0008	0.0027	0.0099
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0059	0.1793	0.1886
Leishmania major	cytochrome p450-like protein	0.001	0.0111	0.0188
Schistosoma mansoni	glutaminase	0.0277	0.9389	0.9387
Plasmodium falciparum	alpha/beta-hydrolase, putative	0.0008	0.0027	0.0061
Mycobacterium tuberculosis	Probable cytochrome P450 132 Cyp132	0.001	0.0111	0.0188
Plasmodium falciparum	alpha/beta hydrolase, putative	0.0008	0.0027	0.0061
Trichomonas vaginalis	histone acetyltransferase gcn5, putative	0.0008	0.0036	0.0009
Echinococcus granulosus	Smad4	0.0009	0.0047	0.002
Schistosoma mansoni	Smad4	0.0009	0.0047	0.0019
Trichomonas vaginalis	Clan SC, family S33, methylesterase-like serine peptidase	0.0136	0.4475	0.4589
Plasmodium vivax	hypothetical protein, conserved	0.0008	0.0027	0.0061
Plasmodium vivax	PST-A protein	0.0008	0.0027	0.0061
Trichomonas vaginalis	Clan SC, family S33, methylesterase-like serine peptidase	0.0136	0.4475	0.4589
Toxoplasma gondii	phospholipase/carboxylesterase	0.0008	0.0027	0.0099
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.001	0.0105	0.0078
Brugia malayi	Cytochrome P450 family protein	0.0019	0.041	0.0384
Onchocerca volvulus		0.0286	0.9719	1
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.001	0.0105	0.0078
Trypanosoma cruzi	Lanosterol 14-alpha demethylase	0.001	0.0111	0.0188
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.001	0.0105	0.008
Brugia malayi	TAR-binding protein	0.0076	0.2415	0.2394
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0055	0.1674	0.1651
Plasmodium falciparum	exported lipase 2	0.0008	0.0027	0.0061
Plasmodium falciparum	lysophospholipase, putative	0.0136	0.4475	1
Brugia malayi	Pre-SET motif family protein	0.0251	0.8509	0.8505
Mycobacterium tuberculosis	Possible lysophospholipase	0.0136	0.4475	1
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.001	0.0105	0.0078
Plasmodium vivax	SET domain protein, putative	0.0036	0.1005	0.2247
Mycobacterium tuberculosis	Probable cytochrome P450 144 Cyp144	0.001	0.0111	0.0188
Plasmodium falciparum	BEM46-like protein, putative	0.0008	0.0027	0.0061
Schistosoma mansoni	tar DNA-binding protein	0.0076	0.2415	0.2394
Plasmodium vivax	unspecified product	0.0008	0.0027	0.0061
Brugia malayi	RNA recognition motif domain containing protein	0.0076	0.2415	0.2394
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.001	0.0105	0.008
Echinococcus multilocularis	dna polymerase kappa	0.002	0.0429	0.0403
Trichomonas vaginalis	conserved hypothetical protein	0.0136	0.4475	0.4589
Echinococcus multilocularis	thyroid hormone receptor alpha	0.001	0.0105	0.0078
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0055	0.1674	0.1651
Mycobacterium tuberculosis	Probable cytochrome P450 128 Cyp128	0.001	0.0111	0.0188
Brugia malayi	MH2 domain containing protein	0.0009	0.0047	0.0019
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.001	0.0105	0.008
Leishmania major	monoglyceride lipase, putative	0.0136	0.4475	1
Loa Loa (eye worm)	glutaminase 2	0.0277	0.9389	0.9387
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.001	0.0105	0.0078
Plasmodium falciparum	alpha/beta hydrolase fold domain containing protein, putative	0.0008	0.0027	0.0061
Mycobacterium ulcerans	cytochrome P450 126A3 Cyp126A3	0.001	0.0111	0.0089
Mycobacterium ulcerans	cytochrome P450 125A7 Cyp125A7	0.001	0.0111	0.0089
Echinococcus multilocularis	dna polymerase eta	0.002	0.0429	0.0403
Trypanosoma brucei	monoglyceride lipase, putative	0.0136	0.4475	1
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0076	0.2415	0.2394
Plasmodium vivax	histone acetyltransferase GCN5, putative	0.0086	0.2763	0.6176
Plasmodium vivax	PST-A protein	0.0008	0.0027	0.0061
Mycobacterium ulcerans	cytochrome P450 187A5 Cyp187A5	0.001	0.0111	0.0089
Mycobacterium ulcerans	cytochrome P450 143A4 Cyp143A4	0.001	0.0111	0.0089
Toxoplasma gondii	aldehyde dehydrogenase	0.0059	0.1793	0.649
Entamoeba histolytica	acetyltransferase, GNAT family	0.0079	0.2512	0.5615
Echinococcus granulosus	dna polymerase eta	0.002	0.0429	0.0415
Loa Loa (eye worm)	hypothetical protein	0.001	0.0105	0.0078
Echinococcus multilocularis	terminal deoxycytidyl transferase rev1	0.002	0.0429	0.0403
Loa Loa (eye worm)	hypothetical protein	0.001	0.0105	0.0078
Brugia malayi	nuclear receptor NHR-88	0.001	0.0105	0.0078
Brugia malayi	Nuclear hormone receptor-like 1	0.001	0.0105	0.0078
Mycobacterium ulcerans	cytochrome P450 108B4 Cyp108B4	0.001	0.0111	0.0089
Loa Loa (eye worm)	glutaminase	0.0277	0.9389	0.9387
Mycobacterium tuberculosis	Probable cytochrome P450 143 Cyp143	0.001	0.0111	0.0188
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0036	0.1005	0.0981
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.001	0.0105	0.0078
Schistosoma mansoni	smad1 5 8 and	0.0009	0.0047	0.0019
Echinococcus granulosus	histone acetyltransferase KAT2B	0.0086	0.2763	0.2825
Plasmodium falciparum	esterase, putative	0.0136	0.4475	1
Plasmodium vivax	lysophospholipase, putative	0.0008	0.0027	0.0061
Trypanosoma brucei	DNA polymerase kappa, putative	0.002	0.0429	0.0904
Entamoeba histolytica	hydrolase, alpha/beta fold family domain containing protein	0.0136	0.4475	1
Plasmodium vivax	PST-A protein	0.0008	0.0027	0.0061
Mycobacterium tuberculosis	Cytochrome P450 51 Cyp51 (CYPL1) (P450-L1A1) (sterol 14-alpha demethylase) (lanosterol 14-alpha demethylase) (P450-14DM)	0.001	0.0111	0.0188
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.001	0.0105	0.0078
Mycobacterium ulcerans	cytochrome P450 144A4 Cyp144A4	0.001	0.0111	0.0089
Toxoplasma gondii	cytochrome p450 superfamily protein	0.001	0.0111	0.0402
Toxoplasma gondii	esterase/lipase/thioesterase domain-containing protein	0.0008	0.0027	0.0099
Mycobacterium ulcerans	cytochrome P450 191A3 Cyp191A3	0.001	0.0111	0.0089
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0059	0.1793	0.1886
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.001	0.0105	0.0078
Toxoplasma gondii	hydrolase, alpha/beta fold family protein	0.0008	0.0027	0.0099
Entamoeba histolytica	hypothetical protein	0.0008	0.0027	0.0061
Plasmodium vivax	PST-A protein	0.0008	0.0027	0.0061
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.001	0.0105	0.0078
Mycobacterium ulcerans	hypothetical protein	0.0136	0.4475	0.475
Mycobacterium ulcerans	cytochrome P450 150A6 Cyp150A6	0.001	0.0111	0.0089
Loa Loa (eye worm)	TAR-binding protein	0.0076	0.2415	0.2394
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.001	0.0105	0.0078
Mycobacterium ulcerans	cytochrome P450 143A3 Cyp143A3	0.001	0.0111	0.0089
Mycobacterium tuberculosis	Probable cytochrome P450 138 Cyp138	0.001	0.0111	0.0188
Plasmodium falciparum	alpha/beta hydrolase, putative	0.0008	0.0027	0.0061
Chlamydia trachomatis	hydrolase	0.0008	0.0027	0.5
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.001	0.0105	0.0078
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.001	0.0105	0.0078
Brugia malayi	MH1 domain containing protein	0.0009	0.0047	0.0019
Trichomonas vaginalis	Clan SC, family S33, methylesterase-like serine peptidase	0.0136	0.4475	0.4589
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0055	0.1674	0.1651
Mycobacterium ulcerans	cytochrome p450 150 cyp150	0.001	0.0111	0.0089
Chlamydia trachomatis	acyltransferase family protein	0.0008	0.0027	0.5
Loa Loa (eye worm)	transcription factor SMAD2	0.0125	0.4118	0.4102
Schistosoma mansoni	aldehyde dehydrogenase	0.0059	0.1793	0.1771
Schistosoma mansoni	cytochrome P450	0.001	0.0111	0.0084
Mycobacterium leprae	POSSIBLE LYSOPHOSPHOLIPASE	0.0136	0.4475	1
Trypanosoma cruzi	DNA polymerase kappa, putative	0.002	0.0429	0.0904
Loa Loa (eye worm)	cytochrome P450	0.001	0.0111	0.0084
Plasmodium vivax	alpha/beta hydrolase, putative	0.0008	0.0027	0.0061
Mycobacterium ulcerans	DNA polymerase IV	0.002	0.0429	0.0429
Trypanosoma cruzi	DNA polymerase kappa, putative	0.002	0.0429	0.0904
Brugia malayi	follicle stimulating hormone receptor	0.0227	0.7653	0.7647
Schistosoma mansoni	tar DNA-binding protein	0.0076	0.2415	0.2394
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.001	0.0105	0.0078
Trichomonas vaginalis	set domain proteins, putative	0.0286	0.9719	1
Brugia malayi	nuclear hormone receptor	0.001	0.0105	0.0078
Mycobacterium tuberculosis	Probable cytochrome P450 137 Cyp137	0.001	0.0111	0.0188
Mycobacterium ulcerans	aldehyde dehydrogenase	0.0059	0.1793	0.1886
Trichomonas vaginalis	DNA polymerase eta, putative	0.002	0.0429	0.0415
Schistosoma mansoni	TGF-beta signal transducer Smad2	0.0009	0.0047	0.0019
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0036	0.1005	0.0981
Trichomonas vaginalis	glutaminase, putative	0.0277	0.9389	0.9659
Mycobacterium tuberculosis	Probable cytochrome P450 141 Cyp141	0.001	0.0111	0.0188
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.001	0.0105	0.008
Loa Loa (eye worm)	hypothetical protein	0.001	0.0105	0.0078
Leishmania major	DNA polymerase kappa, putative	0.002	0.0429	0.0904
Brugia malayi	glutaminase DH11.1	0.0277	0.9389	0.9387
Mycobacterium ulcerans	cytochrome P450 124A1, Cyp124A1	0.001	0.0111	0.0089
Mycobacterium ulcerans	DNA polymerase IV	0.002	0.0429	0.0429
Onchocerca volvulus		0.0036	0.1005	0.0936
Echinococcus multilocularis	Smad4	0.0009	0.0047	0.0019
Trypanosoma brucei	DNA polymerase IV, putative	0.002	0.0429	0.0904
Trypanosoma brucei	DNA polymerase eta, putative	0.002	0.0429	0.0904
Trypanosoma cruzi	cytochrome P450, putative	0.0019	0.041	0.0861
Trypanosoma brucei	DNA polymerase IV, putative	0.002	0.0429	0.0904
Brugia malayi	cytochrome P450	0.001	0.0111	0.0084
Plasmodium falciparum	lysophospholipase, putative	0.0008	0.0027	0.0061
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.0036	0.1005	0.0981
Loa Loa (eye worm)	hypothetical protein	0.001	0.0105	0.0078
Brugia malayi	MH2 domain containing protein	0.0009	0.0047	0.0019
Loa Loa (eye worm)	hypothetical protein	0.001	0.0105	0.0078
Toxoplasma gondii	peptidase S15, putative	0.0008	0.0027	0.0099
Leishmania major	hypothetical protein, conserved	0.0008	0.0027	0.00000011834
Schistosoma mansoni	rab geranylgeranyl transferase alpha subunit	0.002	0.0429	0.0403
Entamoeba histolytica	hydrolase, alpha/beta fold family domain containing protein	0.0136	0.4475	1
Plasmodium falciparum	alpha/beta hydrolase, putative	0.0008	0.0027	0.0061
Mycobacterium tuberculosis	Cytochrome P450 121 Cyp121	0.001	0.0111	0.0188
Toxoplasma gondii	hypothetical protein	0.0008	0.0027	0.0099
Loa Loa (eye worm)	hypothetical protein	0.001	0.0105	0.0078
Mycobacterium tuberculosis	Possible cytochrome P450 135B1 Cyp135B1	0.001	0.0111	0.0188
Trypanosoma cruzi	DNA polymerase kappa, putative	0.002	0.0429	0.0904
Loa Loa (eye worm)	RNA binding protein	0.0076	0.2415	0.2394
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.001	0.0105	0.0078
Plasmodium vivax	lysophospholipase, putative	0.0008	0.0027	0.0061
Loa Loa (eye worm)	hypothetical protein	0.001	0.0105	0.0078
Trypanosoma brucei	monoglyceride lipase, putative	0.0136	0.4475	1
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.001	0.0105	0.0078
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0009	0.0046	0.0167
Schistosoma mansoni	terminal deoxycytidyl transferase	0.002	0.0429	0.0403
Echinococcus granulosus	histone lysine methyltransferase setb	0.0036	0.1005	0.101
Echinococcus granulosus	aldehyde dehydrogenase mitochondrial	0.0059	0.1793	0.1823
Plasmodium vivax	PST-A protein	0.0136	0.4475	1
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.001	0.0105	0.0078
Toxoplasma gondii	hypothetical protein	0.0008	0.0027	0.0099
Echinococcus multilocularis	TGF beta signal transducer SmadC	0.0009	0.0047	0.0019
Trichomonas vaginalis	Clan SC, family S33, methylesterase-like serine peptidase	0.0136	0.4475	0.4589

Activities

Activity type	Activity value	Assay description	Source	Reference
Potency (functional)	0.5171 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)	1 uM	PubChem BioAssay. qHTS of TDP-43 Inhibitors. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	5.0119 uM	PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	10.4179 uM	PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850]	ChEMBL.	No reference
Potency (functional)	11.2202 uM	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404]	ChEMBL.	No reference
Potency (functional)	22.3872 uM	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of JMJD2A-Tudor Domain. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504402]	ChEMBL.	No reference
Potency (functional)	25.1189 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588856, AID588860]	ChEMBL.	No reference
Potency (functional)	= 28.1838 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Fructose-1,6-bisphosphate Aldolase from Giardia Lamblia. (Class of assay: confirmatory) [Related pubchem assays: 2472, 2464 ]	ChEMBL.	No reference
Potency (functional)	35.4813 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b: Cytotox Counterscreen. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588855, AID588860]	ChEMBL.	No reference
Potency (functional)	= 39.8107 um	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Human Jumonji Domain Containing 2E (JMJD2E). (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	47.7548 uM	PubChem BioAssay. qHTS Assay to Find Inhibitors of Pin1. (Class of assay: confirmatory)	ChEMBL.	No reference
Potency (functional)	89.1251 uM	PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of BAZ2B. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504391]	ChEMBL.	No reference
Potency (functional)	89.1251 uM	PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623]	ChEMBL.	No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Plasmodium falciparum	ChEMBL23
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: CHEMBL1466917

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1331215