TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 366.497 | Formula: C23H30N2O2
H donors: 2 H acceptors: 1 LogP: 3.9 Rotable bonds: 8
Rule of 5 violations (Lipinski): 1
SMILES: OC(CNC(Cc1cc2c(n1C)cccc2)(C)C)COc1ccccc1C
InChi: 1S/C23H30N2O2/c1-17-9-5-8-12-22(17)27-16-20(26)15-24-23(2,3)14-19-13-18-10-6-7-11-21(18)25(19)4/h5-13,20,24,26H,14-16H2,1-4H3
InChiKey: JVYPWIMDYUZMFN-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

No synonyms found for this compound

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	cytochrome P450, family 2, subfamily D, polypeptide 6	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

No druggable targets predicted by orthology data

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Brugia malayi	cytochrome P450	cytochrome P450, family 2, subfamily D, polypeptide 6	497 aa	425 aa	32.0 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0201	0.0318
Echinococcus granulosus	calcium dependent protein kinase	0.003	0.0552	0.0618
Plasmodium vivax	mitogen-activated protein kinase 2, putative	0.0169	0.3724	0.3724
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0105	0.2253	0.2523
Entamoeba histolytica	hypothetical protein	0.0023	0.0399	0.0628
Trichomonas vaginalis	sugar transport protein, putative	0.0015	0.0201	0.0318
Giardia lamblia	Fructose-bisphosphate aldolase	0.0284	0.6343	1
Trypanosoma brucei	lysyl-tRNA synthetase, putative	0.0023	0.0399	0.5689
Schistosoma mansoni	chromobox protein-related (chromobox 1) (heterochromatin 1)	0.0022	0.0374	0.0419
Brugia malayi	Latrophilin receptor protein 2	0.0031	0.0564	0.1241
Plasmodium vivax	CDK-related protein kinase 6, putative	0.0444	1	1
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0201	0.0318
Loa Loa (eye worm)	hypothetical protein	0.0145	0.3176	0.6992
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0029	0.0518	0.0817
Brugia malayi	CXXC zinc finger family protein	0.0028	0.0502	0.1105
Echinococcus granulosus	solute carrier family 22	0.0015	0.0201	0.0226
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0032	0.0597	0.0668
Entamoeba histolytica	protein kinase, putative	0.0032	0.0597	0.0941
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	0.0284	0.6343	1
Brugia malayi	Sugar transporter family protein	0.0015	0.0201	0.0443
Brugia malayi	Sugar transporter family protein	0.0015	0.0201	0.0443
Toxoplasma gondii	lysine-tRNA ligase	0.0023	0.0399	0.0603
Trichomonas vaginalis	conserved hypothetical protein	0.0022	0.0374	0.0589
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.0029	0.0518	0.0817
Chlamydia trachomatis	lysine--tRNA ligase	0.0023	0.0399	1
Plasmodium falciparum	major facilitator superfamily domain-containing protein, putative	0.0015	0.0201	0.0201
Trichomonas vaginalis	conserved hypothetical protein	0.0022	0.0374	0.0589
Echinococcus granulosus	chromodomain helicase DNA binding protein 4	0.0024	0.041	0.0459
Plasmodium falciparum	protein kinase 7	0.0296	0.6612	0.6612
Trichomonas vaginalis	glucose transporter, putative	0.0015	0.0201	0.0318
Trichomonas vaginalis	conserved hypothetical protein	0.0006	0.001	0.0016
Schistosoma mansoni	serine/threonine protein kinase	0.0032	0.0597	0.0668
Giardia lamblia	Hexose transporter	0.0015	0.0201	0.0318
Schistosoma mansoni	cpg binding protein	0.0028	0.0502	0.0562
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0201	0.0318
Trypanosoma brucei	myo-inositol/proton symporter (MIT)	0.0015	0.0201	0.2874
Echinococcus multilocularis	chromodomain helicase DNA binding protein 4	0.0024	0.041	0.0459
Trypanosoma brucei	sugar transporter, putative	0.0015	0.0201	0.2874
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.003	0.0548	0.0614
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.001	0.0087	0.0098
Mycobacterium tuberculosis	Lysyl-tRNA synthetase 2 LysX	0.002	0.0318	0.1051
Trypanosoma brucei	calcium/calmodulin-dependent protein kinase, putative	0.0032	0.0597	0.8517
Plasmodium falciparum	calcium-dependent protein kinase 1	0.0032	0.0597	0.0597
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0284	0.6343	1
Trypanosoma cruzi	hexose transporter, putative	0.0018	0.027	0.386
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0201	0.0443
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0582	0.1281
Mycobacterium ulcerans	lysyl-tRNA synthetase	0.0023	0.0399	0.1316
Schistosoma mansoni	chromobox protein	0.0022	0.0374	0.0419
Onchocerca volvulus	Heterochromatin protein 1 homolog	0.0082	0.1738	0.3083
Echinococcus multilocularis	Chromo domain	0.0022	0.0374	0.0419
Schistosoma mansoni	protein kinase	0.0032	0.0597	0.0668
Loa Loa (eye worm)	sugar transporter	0.0105	0.2253	0.4961
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0201	0.0318
Mycobacterium leprae	Possible lysyl-tRNA synthetase 2 LysX	0.0023	0.0399	0.1316
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0201	0.0318
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0054	0.1096	0.1658
Plasmodium falciparum	chromodomain-helicase-DNA-binding protein 1 homolog, putative	0.0022	0.0374	0.0374
Echinococcus multilocularis	solute carrier family 22	0.0015	0.0201	0.0226
Trichomonas vaginalis	conserved hypothetical protein	0.0076	0.1606	0.2532
Onchocerca volvulus		0.006	0.123	0.2064
Brugia malayi	latrophilin 2 splice variant baaae	0.0066	0.1374	0.3025
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0606	0.8651
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0201	0.0318
Echinococcus granulosus	glutamyl tRNA synthetase cytoplasmic	0.0031	0.0582	0.0652
Brugia malayi	Associated with TFs and helicases family protein	0.0022	0.0374	0.0823
Onchocerca volvulus		0.0052	0.1057	0.1715
Schistosoma mansoni	cpg binding protein	0.0029	0.0538	0.0603
Brugia malayi	F/Y-rich N-terminus family protein	0.001	0.0085	0.0186
Trypanosoma cruzi	sugar transporter, putative	0.0015	0.0201	0.2874
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0032	0.0597	0.0668
Echinococcus multilocularis	muscleblind protein 1	0.0145	0.3176	0.3557
Brugia malayi	major facilitator superfamily protein	0.0015	0.0201	0.0443
Brugia malayi	Valyl-tRNA synthetase	0.0022	0.0374	0.0823
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0399	0.0878
Trichomonas vaginalis	conserved hypothetical protein	0.0076	0.1606	0.2532
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0031	0.0564	0.1241
Echinococcus multilocularis	glutamyl tRNA synthetase cytoplasmic	0.0031	0.0582	0.0652
Trichomonas vaginalis	conserved hypothetical protein	0.0006	0.001	0.0016
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0201	0.0318
Trichomonas vaginalis	conserved hypothetical protein	0.0054	0.1098	0.1731
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.003	0.0548	0.0614
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0028	0.0502	0.1105
Echinococcus multilocularis	muscleblind protein	0.0145	0.3176	0.3557
Plasmodium falciparum	heterochromatin protein 1	0.0022	0.0374	0.0374
Loa Loa (eye worm)	CAMK/CAMK2 protein kinase	0.0032	0.0597	0.1314
Loa Loa (eye worm)	hypothetical protein	0.003	0.0548	0.1207
Schistosoma mansoni	lysyl-tRNA synthetase	0.0023	0.0399	0.0446
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0201	0.0443
Trypanosoma cruzi	hexose transporter, putative	0.0015	0.0201	0.2874
Trichomonas vaginalis	conserved hypothetical protein	0.0006	0.001	0.0016
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0201	0.0318
Echinococcus multilocularis	solute carrier family 22	0.0015	0.0201	0.0226
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0201	0.0318
Trichomonas vaginalis	conserved hypothetical protein	0.0006	0.001	0.0016
Leishmania major	protein kinase, putative	0.0032	0.0597	0.8517
Schistosoma mansoni	glucose transport protein	0.0105	0.2253	0.2523
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0105	0.2253	0.2523
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0031	0.0564	0.0631
Onchocerca volvulus		0.0022	0.0374	0.0346
Plasmodium vivax	SET domain protein, putative	0.003	0.0548	0.0548
Onchocerca volvulus		0.0022	0.0374	0.0346
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0201	0.0318
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0031	0.0564	0.0631
Leishmania major	glucose transporter, lmgt2	0.0032	0.0606	0.8651
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0105	0.2253	0.2523
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.009	0.191	0.2139
Chlamydia trachomatis	proline--tRNA ligase	0.0011	0.0119	0.2978
Trichomonas vaginalis	sugar transporter, putative	0.0032	0.0606	0.0956
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0201	0.0443
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0025	0.0441	0.0695
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0031	0.0564	0.1241
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.003	0.0548	0.0614
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0201	0.0318
Plasmodium falciparum	conserved Plasmodium protein, unknown function	0.0022	0.0374	0.0374
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0201	0.0318
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.006	0.124	0.1389
Trichomonas vaginalis	sugar transporter, putative	0.0032	0.0606	0.0956
Echinococcus granulosus	5'partial\|histone lysine N methyltransferase SETDB2	0.0028	0.051	0.0571
Trichomonas vaginalis	conserved hypothetical protein	0.0015	0.0201	0.0318
Echinococcus multilocularis	chromobox protein 2	0.0022	0.0374	0.0419
Echinococcus granulosus	solute carrier family 22	0.0015	0.0201	0.0226
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0029	0.0518	0.0817
Brugia malayi	Major Facilitator Superfamily protein	0.0015	0.0201	0.0443
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.0205	0.4542	1
Leishmania major	glucose transporter/membrane transporter D2, putative	0.0032	0.0606	0.8651
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0201	0.0318
Trichomonas vaginalis	myo-inositol transporter, putative	0.0015	0.0201	0.0318
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0029	0.0518	0.0817
Trichomonas vaginalis	conserved hypothetical protein	0.0032	0.0606	0.0956
Brugia malayi	hypothetical protein	0.0015	0.0201	0.0443
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0201	0.0318
Entamoeba histolytica	hypothetical protein	0.0022	0.0374	0.0589
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0032	0.0606	0.8651
Plasmodium falciparum	calcium-dependent protein kinase 2	0.0032	0.0597	0.0597
Entamoeba histolytica	fructose-1,6-bisphosphate aldolase, putative	0.0284	0.6343	1
Echinococcus multilocularis	GPCR, family 2	0.0031	0.0564	0.0631
Echinococcus granulosus	muscleblind protein	0.0145	0.3176	0.3557
Brugia malayi	Calcium/calmodulin-dependent protein kinase type II alpha chain	0.0032	0.0597	0.1314
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0201	0.0443
Plasmodium vivax	calcium-dependent protein kinase 1, putative	0.0032	0.0597	0.0597
Schistosoma mansoni	glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs)	0.0031	0.0582	0.0652
Loa Loa (eye worm)	hypothetical protein	0.0022	0.0374	0.0823
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.0052	0.1057	0.1183
Toxoplasma gondii	'chromo' (CHRromatin Organization MOdifier) domain-containing protein	0.0022	0.0374	0.0565
Brugia malayi	Muscleblind-like protein	0.0145	0.3176	0.6992
Toxoplasma gondii	protein kinase, putative	0.0296	0.6612	1
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.009	0.191	0.4205
Echinococcus multilocularis	solute carrier family 22	0.0015	0.0201	0.0226
Onchocerca volvulus	Heterochromatin protein 1 homolog	0.0076	0.1606	0.2818
Echinococcus multilocularis	dnaJ subfamily B	0.0397	0.893	1
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0201	0.0443
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0582	0.1281
Plasmodium falciparum	lysine--tRNA ligase	0.0023	0.0399	0.0399
Plasmodium vivax	calcium-dependent protein kinase, putative	0.0032	0.0597	0.0597
Loa Loa (eye worm)	histone methyltransferase	0.001	0.0087	0.0192
Trichomonas vaginalis	conserved hypothetical protein	0.0006	0.001	0.0016
Brugia malayi	Heterochromatin protein 1	0.0136	0.2971	0.654
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.0008	0.0048	0.0054
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.009	0.191	0.2139
Leishmania major	myo-inositol/proton symporter (MIT)	0.0015	0.0201	0.2874
Trichomonas vaginalis	conserved hypothetical protein	0.0022	0.0374	0.0589
Brugia malayi	Bifunctional aminoacyl-tRNA synthetase	0.0031	0.0582	0.1281
Trichomonas vaginalis	conserved hypothetical protein	0.0015	0.0201	0.0318
Schistosoma mansoni	nuclear transcription factor X-box binding 1 (nfx1)	0.0015	0.0201	0.0226
Trichomonas vaginalis	lysyl-tRNA synthetase, putative	0.002	0.0333	0.0525
Schistosoma mansoni	chromobox protein	0.0136	0.2971	0.3327
Schistosoma mansoni	glucose transport protein	0.0105	0.2253	0.2523
Loa Loa (eye worm)	hypothetical protein	0.0076	0.1606	0.3536
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0029	0.0518	0.0817
Schistosoma mansoni	hypothetical protein	0.0397	0.893	1
Mycobacterium ulcerans	sugar transporter	0.0015	0.0201	0.0665
Brugia malayi	bifunctional aminoacyl-tRNA synthetase	0.0031	0.0582	0.1281
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.009	0.191	0.2139
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0201	0.0318
Schistosoma mansoni	hypothetical protein	0.0022	0.0374	0.0419
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0606	0.8651
Echinococcus granulosus	General substrate transporter	0.009	0.1918	0.2147
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.0026	0.0451	0.0711
Toxoplasma gondii	chromodomain helicase DNA binding protein CHD1/SWI2/SNF2	0.0022	0.0374	0.0565
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0008	0.0048	0.0054
Mycobacterium ulcerans	sugar-transport integral membrane protein SugI	0.0015	0.0201	0.0665
Plasmodium vivax	hypothetical protein, conserved	0.0022	0.0374	0.0374
Loa Loa (eye worm)	sugar transporter	0.0015	0.0201	0.0443
Leishmania major	glucose transporter, lmgt3	0.0032	0.0606	0.8651
Plasmodium vivax	heterochromatin protein 1, putative	0.0022	0.0374	0.0374
Toxoplasma gondii	sugar transporter ST3	0.0015	0.0201	0.0305
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0284	0.6343	1
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0032	0.0597	0.0668
Schistosoma mansoni	chromobox protein	0.0136	0.2971	0.3327
Trichomonas vaginalis	hypothetical protein	0.0022	0.0374	0.0589
Trichomonas vaginalis	chromobox protein, putative	0.0136	0.2971	0.4683
Echinococcus multilocularis	solute carrier family 2, facilitated glucose	0.0105	0.2253	0.2523
Echinococcus granulosus	synaptic vesicle 2 protein	0.0015	0.0201	0.0226
Loa Loa (eye worm)	calcium/calmodulin-dependent protein kinase ID	0.0032	0.0597	0.1314
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0032	0.0597	0.0668
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0201	0.0318
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0201	0.0318
Mycobacterium tuberculosis	Probable fructose-bisphosphate aldolase Fba	0.0139	0.303	1
Entamoeba histolytica	chromodomain-helicase-DNA-binding protein, putative	0.0022	0.0374	0.0589
Loa Loa (eye worm)	hypothetical protein	0.0022	0.0374	0.0823
Trichomonas vaginalis	conserved hypothetical protein	0.0015	0.0201	0.0318
Schistosoma mansoni	sugar transporter	0.0015	0.0201	0.0226
Trichomonas vaginalis	conserved hypothetical protein	0.0054	0.1098	0.1731
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0032	0.0606	0.8651
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.0029	0.0518	0.0817
Trichomonas vaginalis	conserved hypothetical protein	0.0015	0.0201	0.0318
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0031	0.0564	0.0631
Treponema pallidum	prolyl-tRNA synthetase	0.0011	0.0119	0.0187
Echinococcus granulosus	solute carrier family 22	0.0015	0.0201	0.0226
Echinococcus multilocularis	histone lysine N methyltransferase MLL3	0.0008	0.0048	0.0054
Trichomonas vaginalis	Heterochromatin protein, putative	0.0022	0.0374	0.0589
Mycobacterium ulcerans	lysyl-tRNA synthetase	0.0023	0.0399	0.1316
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0606	0.8651
Loa Loa (eye worm)	heterochromatin protein 1	0.0136	0.2971	0.654
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0031	0.0564	0.0631
Echinococcus multilocularis	histone lysine N methyltransferase SETMAR	0.003	0.0548	0.0614
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0201	0.0443
Plasmodium vivax	lysine--tRNA ligase, putative	0.0023	0.0399	0.0399
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.009	0.191	0.4205
Brugia malayi	Pre-SET motif family protein	0.003	0.0548	0.1207
Echinococcus multilocularis	solute carrier family 2 facilitated glucose	0.0105	0.2253	0.2523
Trichomonas vaginalis	sugar transporter, putative	0.0032	0.0606	0.0956
Entamoeba histolytica	protein kinase, putative	0.0032	0.0597	0.0941
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.0022	0.0374	0.0589
Mycobacterium tuberculosis	Probable dicarboxylic acid transport integral membrane protein KgtP (dicarboxylate transporter)	0.0015	0.0201	0.0665
Brugia malayi	Type III restriction enzyme, res subunit family protein	0.0022	0.0374	0.0823
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type	0.0032	0.0597	0.0668
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0201	0.0318
Entamoeba histolytica	chromodomain-helicase-DNA-binding protein, putative	0.0022	0.0374	0.0589
Loa Loa (eye worm)	hypothetical protein	0.0026	0.0448	0.0986
Trichomonas vaginalis	chromobox protein, putative	0.0136	0.2971	0.4683
Loa Loa (eye worm)	hypothetical protein	0.0022	0.0374	0.0823
Brugia malayi	M-phase phosphoprotein, mpp8	0.0022	0.0374	0.0823
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0029	0.0518	0.0817
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.0022	0.0374	0.0589
Trichomonas vaginalis	conserved hypothetical protein	0.0022	0.0374	0.0589
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0201	0.0318
Plasmodium vivax	hexose transporter	0.0105	0.2253	0.2253
Echinococcus multilocularis	lysyl tRNA synthetase	0.0023	0.0399	0.0446
Trichomonas vaginalis	conserved hypothetical protein	0.0006	0.001	0.0016
Echinococcus granulosus	GPCR family 2	0.0031	0.0564	0.0631
Loa Loa (eye worm)	hypothetical protein	0.0022	0.0374	0.0823
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0105	0.2253	0.2523
Echinococcus granulosus	chromobox protein 2	0.0022	0.0374	0.0419
Mycobacterium leprae	Probable prolyl tRNA synthetase ProS	0.0031	0.0582	0.1921
Loa Loa (eye worm)	hypothetical protein	0.0022	0.0374	0.0823
Trichomonas vaginalis	conserved hypothetical protein	0.0022	0.0374	0.0589
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0032	0.0597	0.0668
Trypanosoma cruzi	hexose transporter, putative	0.0032	0.0606	0.8651
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0606	0.8651
Brugia malayi	CHD4 protein	0.0024	0.041	0.0903
Brugia malayi	chromobox protein homolog 3	0.0076	0.1606	0.3536
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0606	0.8651
Brugia malayi	Cam kinase protein 1	0.0032	0.0597	0.1314
Mycobacterium tuberculosis	Probable conserved integral membrane transport protein	0.0015	0.0201	0.0665
Toxoplasma gondii	'chromo' (CHRromatin Organization MOdifier) domain-containing protein	0.0022	0.0374	0.0565
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0029	0.0518	0.0817
Schistosoma mansoni	chromodomain helicase DNA binding protein	0.0022	0.0374	0.0419
Schistosoma mansoni	protein kinase	0.0032	0.0597	0.0668
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0105	0.2253	0.2523
Schistosoma mansoni	hypothetical protein	0.0031	0.0564	0.0631
Toxoplasma gondii	facilitative glucose transporter GT1	0.0105	0.2253	0.3408
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0201	0.0318
Plasmodium falciparum	mitogen-activated protein kinase 2	0.0169	0.3724	0.3724
Echinococcus granulosus	chromobox protein 1	0.0136	0.2971	0.3327
Wolbachia endosymbiont of Brugia malayi	major facilitator superfamily permease	0.0015	0.0201	1
Trypanosoma brucei	THT1 - hexose transporter, putative	0.0032	0.0606	0.8651
Trypanosoma cruzi	hexose transporter	0.0032	0.0606	0.8651
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0201	0.0318
Echinococcus granulosus	Chromobox protein 3	0.0022	0.0374	0.0419
Trichomonas vaginalis	conserved hypothetical protein	0.0006	0.001	0.0016
Echinococcus multilocularis	calcium:calmodulin dependent protein kinase type	0.0032	0.0597	0.0668
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0201	0.0318
Trichomonas vaginalis	prolyl-tRNA synthetase, putative	0.0031	0.0582	0.0918
Trypanosoma cruzi	prolyl-tRNA synthetase, putative	0.0037	0.0701	1
Trypanosoma brucei	glucose transporter 2A	0.0032	0.0606	0.8651
Trichomonas vaginalis	CAMK family protein kinase	0.0032	0.0597	0.0941
Trypanosoma cruzi	glucose transporter, putative	0.0015	0.0201	0.2874
Toxoplasma gondii	sugar transporter ST2	0.0015	0.0201	0.0305
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0201	0.0443
Loa Loa (eye worm)	major facilitator superfamily transporter	0.0015	0.0201	0.0443
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0201	0.0318
Loa Loa (eye worm)	hypothetical protein	0.0032	0.0597	0.1314
Trichomonas vaginalis	conserved hypothetical protein	0.0026	0.0451	0.0711
Loa Loa (eye worm)	helicase	0.0022	0.0374	0.0823
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0201	0.0318
Brugia malayi	Protein cec-1.	0.0022	0.0374	0.0823
Trichomonas vaginalis	glucose transporter, putative	0.0032	0.0606	0.0956
Mycobacterium tuberculosis	Lysyl-tRNA synthetase 1 LysS (lysine--tRNA ligase 1) (LysRS 1) (lysine translase)	0.002	0.0318	0.1051
Echinococcus multilocularis	chromobox protein 1	0.0136	0.2971	0.3327
Giardia lamblia	Prolyl-tRNA synthetase	0.0031	0.0582	0.0918
Loa Loa (eye worm)	hypothetical protein	0.0022	0.0374	0.0823
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0201	0.0443
Echinococcus multilocularis	solute carrier family 22	0.0015	0.0201	0.0226
Plasmodium vivax	calcium-dependent protein kinase 4, putative	0.0032	0.0597	0.0597
Schistosoma mansoni	chromobox protein	0.0022	0.0374	0.0419
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0201	0.0318
Loa Loa (eye worm)	hypothetical protein	0.0097	0.2072	0.4562
Mycobacterium ulcerans	prolyl-tRNA synthetase	0.0011	0.0119	0.0392
Echinococcus granulosus	Chromo domain	0.0022	0.0374	0.0419
Loa Loa (eye worm)	major facilitator superfamily transporter	0.0015	0.0201	0.0443
Leishmania major	prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative	0.0037	0.0701	1
Brugia malayi	Major Facilitator Superfamily protein	0.0015	0.0201	0.0443
Echinococcus multilocularis	calcium dependent protein kinase	0.003	0.0552	0.0618
Onchocerca volvulus		0.0028	0.0502	0.0603
Plasmodium vivax	calcium-dependent protein kinase 3, putative	0.0032	0.0597	0.0597
Leishmania major	glucose transporter, lmgt1	0.0032	0.0606	0.8651
Brugia malayi	SET domain containing protein	0.0024	0.0412	0.0908
Toxoplasma gondii	histone lysine methyltransferase SET/SUV39	0.003	0.0548	0.0829
Brugia malayi	hypothetical protein	0.0015	0.0201	0.0443
Trichomonas vaginalis	helicase, putative	0.0006	0.001	0.0016
Schistosoma mansoni	hypothetical protein	0.0031	0.0564	0.0631
Leishmania major	prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative	0.0037	0.0701	1
Trichomonas vaginalis	conserved hypothetical protein	0.0022	0.0374	0.0589
Echinococcus granulosus	chromodomain helicase DNA binding protein 1	0.0022	0.0374	0.0419
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0201	0.0318
Trichomonas vaginalis	chromobox protein, putative	0.0082	0.1738	0.2741
Loa Loa (eye worm)	hypothetical protein	0.0066	0.1374	0.3025
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0284	0.6343	1
Leishmania major	lysyl-tRNA synthetase, putative	0.0023	0.0399	0.5689
Toxoplasma gondii	calcium-dependent protein kinase CDPK3	0.0032	0.0597	0.0903
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0284	0.6343	1
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0606	0.8651
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0201	0.0443
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0097	0.2072	0.4562
Trypanosoma cruzi	lysyl-tRNA synthetase, putative	0.0023	0.0399	0.5689
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0201	0.0318
Loa Loa (eye worm)	CHromoDomain protein family member	0.0024	0.041	0.0903
Brugia malayi	hypothetical protein	0.0022	0.0374	0.0823
Trypanosoma cruzi	hexose transporter, putative	0.0032	0.0606	0.8651
Echinococcus granulosus	Sugar transporter ERD6 protein	0.0015	0.0201	0.0226
Mycobacterium leprae	Probable fructose bisphosphate aldolase Fba	0.0139	0.303	1
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0201	0.0443
Plasmodium vivax	hypothetical protein, conserved	0.0022	0.0374	0.0374
Echinococcus granulosus	histone lysine N methyltransferase MLL3	0.001	0.0087	0.0098
Schistosoma mansoni	hypothetical protein	0.0031	0.0564	0.0631
Mycobacterium leprae	Probable lysyl-tRNA synthase LysS (lysine--tRNA ligase 1) (LysRS 1) (lysine translase)	0.002	0.0318	0.1051
Echinococcus multilocularis	chromobox protein 1	0.0136	0.2971	0.3327
Trichomonas vaginalis	conserved hypothetical protein	0.0022	0.0374	0.0589
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.003	0.0548	0.0614
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0097	0.2072	0.4562
Echinococcus granulosus	chromobox protein 1	0.0136	0.2971	0.3327
Schistosoma mansoni	chromobox protein-related (chromobox 1) (heterochromatin 1)	0.0022	0.0374	0.0419
Onchocerca volvulus		0.0233	0.5187	1
Treponema pallidum	fructose-bisphosphate aldolase	0.0284	0.6343	1
Schistosoma mansoni	sugar transporter	0.0015	0.0201	0.0226
Trichomonas vaginalis	chromobox protein, putative	0.0022	0.0374	0.0589
Leishmania major	hypothetical protein, conserved	0.0015	0.0201	0.2874
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0201	0.0443
Schistosoma mansoni	glucose transport protein	0.0105	0.2253	0.2523
Giardia lamblia	Sugar-proton symporter	0.0015	0.0201	0.0318
Echinococcus granulosus	solute carrier family 2 facilitated glucose	0.0105	0.2253	0.2523
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0284	0.6343	1
Echinococcus granulosus	dnaJ subfamily B	0.0397	0.893	1
Trichomonas vaginalis	conserved hypothetical protein	0.0105	0.2253	0.3553
Echinococcus multilocularis	cpg binding protein	0.0029	0.0538	0.0603
Mycobacterium ulcerans	fusion protein of transposase for IS2606 and sialic acid-transport integral membrane protein NanT	0.0015	0.0201	0.0665
Echinococcus granulosus	histone lysine methyltransferase setb	0.003	0.0548	0.0614
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0201	0.0443
Toxoplasma gondii	sugar transporter ST1	0.0015	0.0201	0.0305
Trichomonas vaginalis	conserved hypothetical protein	0.0006	0.001	0.0016
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.009	0.191	0.2139
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0284	0.6343	1
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.009	0.191	0.2139
Trichomonas vaginalis	glucose transporter, putative	0.0032	0.0606	0.0956
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0606	0.8651
Echinococcus granulosus	lysyl tRNA synthetase	0.0023	0.0399	0.0446
Schistosoma mansoni	chromodomain helicase DNA binding protein	0.0024	0.041	0.0459
Trypanosoma cruzi	hexose transporter, putative	0.0032	0.0606	0.8651
Echinococcus granulosus	cpg binding protein	0.0029	0.0538	0.0603
Brugia malayi	hypothetical protein	0.0015	0.0201	0.0443
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.009	0.191	0.2139
Trichomonas vaginalis	chromobox protein, putative	0.0022	0.0374	0.0589
Plasmodium falciparum	calcium-dependent protein kinase 4	0.0032	0.0597	0.0597
Schistosoma mansoni	hypothetical protein	0.0031	0.0564	0.0631
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.009	0.191	0.2139
Trichomonas vaginalis	lysyl-tRNA synthetase, putative	0.0023	0.0399	0.0628
Trichomonas vaginalis	conserved hypothetical protein	0.0015	0.0201	0.0318
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0201	0.0443
Toxoplasma gondii	calcium-dependent protein kinase CDPK2A	0.0032	0.0597	0.0903
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0284	0.6343	1
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0201	0.0318
Plasmodium falciparum	calcium-dependent protein kinase 5	0.0032	0.0597	0.0597
Toxoplasma gondii	transporter, major facilitator family protein	0.0015	0.0201	0.0305
Trichomonas vaginalis	conserved hypothetical protein	0.0022	0.0374	0.0589
Plasmodium vivax	proline--tRNA ligase, putative	0.0037	0.0701	0.0701
Loa Loa (eye worm)	bifunctional aminoacyl-tRNA synthetase	0.0013	0.016	0.0352
Plasmodium falciparum	hexose transporter	0.0105	0.2253	0.2253
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0201	0.0318
Plasmodium falciparum	calcium-dependent protein kinase 3	0.0032	0.0597	0.0597
Schistosoma mansoni	hypothetical protein	0.0105	0.2253	0.2523
Trichomonas vaginalis	conserved hypothetical protein	0.0032	0.0606	0.0956
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0201	0.0443
Entamoeba histolytica	chromodomain-helicase-DNA-binding protein, putative	0.0022	0.0374	0.0589
Brugia malayi	Pre-SET motif family protein	0.0205	0.4542	1
Echinococcus multilocularis	chromodomain helicase DNA binding protein 1	0.0022	0.0374	0.0419
Entamoeba histolytica	hypothetical protein	0.0022	0.0374	0.0589
Schistosoma mansoni	sugar transporter	0.0015	0.0201	0.0226
Trichomonas vaginalis	set domain proteins, putative	0.0233	0.5187	0.8177
Brugia malayi	major facilitator superfamily protein	0.0015	0.0201	0.0443
Schistosoma mansoni	lysyl-tRNA synthetase	0.0023	0.0399	0.0446
Loa Loa (eye worm)	hypothetical protein	0.0022	0.0374	0.0823
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0201	0.0318
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0201	0.0318
Echinococcus multilocularis	synaptic vesicle 2 protein	0.0015	0.0201	0.0226
Entamoeba histolytica	prolyl-tRNA synthetase, putative	0.0031	0.0582	0.0918
Echinococcus granulosus	calcium:calmodulin dependent protein kinase type 1	0.0032	0.0597	0.0668
Trypanosoma brucei	glucose transporter, putative	0.0032	0.0606	0.8651
Echinococcus multilocularis	Chromobox protein 3	0.0022	0.0374	0.0419
Giardia lamblia	Lysyl-tRNA synthetase	0.0023	0.0399	0.0628
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0564	0.1241
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0201	0.0318
Trichomonas vaginalis	chromobox protein, putative	0.0022	0.0374	0.0589
Schistosoma mansoni	glucose transporter	0.0015	0.0201	0.0226
Plasmodium vivax	sugar transporter, putative	0.0015	0.0201	0.0201
Toxoplasma gondii	prolyl-tRNA synthetase (ProRS)	0.0037	0.0701	0.106
Trichomonas vaginalis	fructose-bisphosphate aldolase, putative	0.0284	0.6343	1
Brugia malayi	Sugar transporter family protein	0.0105	0.2253	0.4961
Trypanosoma brucei	bifunctional aminoacyl-tRNA synthetase, putative	0.0037	0.0701	1
Brugia malayi	Major Facilitator Superfamily protein	0.0015	0.0201	0.0443
Plasmodium falciparum	proline--tRNA ligase	0.0037	0.0701	0.0701
Trypanosoma brucei	glucose transporter 1E	0.0032	0.0606	0.8651
Echinococcus multilocularis	mixed lineage leukemia protein mll	0.0008	0.0048	0.0054
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0022	0.0374	0.0589
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0097	0.2072	0.4562
Loa Loa (eye worm)	hypothetical protein	0.0145	0.3176	0.6992
Schistosoma mansoni	protein kinase	0.0032	0.0597	0.0668
Trichomonas vaginalis	conserved hypothetical protein	0.0006	0.001	0.0016
Trypanosoma cruzi	prolyl-tRNA synthetase, putative	0.0037	0.0701	1
Trichomonas vaginalis	chromobox protein, putative	0.0082	0.1738	0.2741
Brugia malayi	lysyl-tRNA synthetase	0.0023	0.0399	0.0878
Schistosoma mansoni	glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs)	0.0031	0.0582	0.0652
Toxoplasma gondii	calcium-dependent protein kinase CDPK2B	0.0032	0.0597	0.0903
Echinococcus granulosus	mixed lineage leukemia protein mll	0.0008	0.0048	0.0054
Schistosoma mansoni	sugar transporter	0.0015	0.0201	0.0226
Entamoeba histolytica	hypothetical protein	0.0022	0.0374	0.0589
Schistosoma mansoni	cpg binding protein	0.0029	0.0538	0.0603
Mycobacterium ulcerans	integral membrane transport protein	0.0015	0.0201	0.0665
Mycobacterium ulcerans	fructose-bisphosphate aldolase	0.0139	0.303	1
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0201	0.0318
Loa Loa (eye worm)	hypothetical protein	0.006	0.123	0.2708
Echinococcus multilocularis	Sugar transporter ERD6 protein	0.0015	0.0201	0.0226
Schistosoma mansoni	hypothetical protein	0.0066	0.1374	0.1539
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0201	0.0318
Loa Loa (eye worm)	hypothetical protein	0.0015	0.0201	0.0443
Echinococcus multilocularis	General substrate transporter	0.009	0.1918	0.2147
Echinococcus granulosus	solute carrier family 22	0.0015	0.0201	0.0226
Toxoplasma gondii	cell-cycle-associated protein kinase MAPK, putative	0.0169	0.3724	0.5632
Trichomonas vaginalis	sugar transporter, putative	0.0015	0.0201	0.0318

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (ADMET)	= 0.09 uM	Inhibitory activity against recombinant human Cytochrome P450 2D6 (CYP2D6) after incubated for 45 minutes	ChEMBL.	15993593
IC50 (ADMET)	= 0.09 uM	Inhibitory activity against recombinant human Cytochrome P450 2D6 (CYP2D6) after incubated for 45 minutes	ChEMBL.	15993593

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.

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External resources for this compound

No external resources registered for this compound

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 314896