TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 389.556 | Formula: C24H27N3S
H donors: 1 H acceptors: 1 LogP: 5.24 Rotable bonds: 6
Rule of 5 violations (Lipinski): 1
SMILES: C1CN(CC(C1)Nc1cccc2c1ccnc2)Cc1ccc(cc1)SC1CC1
InChi: 1S/C24H27N3S/c1-3-19-15-25-13-12-23(19)24(5-1)26-20-4-2-14-27(17-20)16-18-6-8-21(9-7-18)28-22-10-11-22/h1,3,5-9,12-13,15,20,22,26H,2,4,10-11,14,16-17H2
InChiKey: XPXJREKHQWNIQZ-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	Rho-associated, coiled-coil containing protein kinase 2	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Echinococcus multilocularis	rho associated protein kinase	Get druggable targets OG5_131020	All targets in OG5_131020
Schistosoma japonicum	IPR002219,Protein kinase C, phorbol ester/diacylglycerol binding,domain-containing	Get druggable targets OG5_131020	All targets in OG5_131020
Echinococcus granulosus	rho-associated protein kinase 1	Get druggable targets OG5_131020	All targets in OG5_131020
Loa Loa (eye worm)	AGC/DMPK/ROCK protein kinase	Get druggable targets OG5_131020	All targets in OG5_131020
Schistosoma mansoni	serine/threonine protein kinase	Get druggable targets OG5_131020	All targets in OG5_131020
Onchocerca volvulus		Get druggable targets OG5_131020	All targets in OG5_131020
Brugia malayi	Protein kinase domain containing protein	Get druggable targets OG5_131020	All targets in OG5_131020
Onchocerca volvulus		Get druggable targets OG5_131020	All targets in OG5_131020
Schistosoma japonicum	Rho-associated protein kinase 1, putative	Get druggable targets OG5_131020	All targets in OG5_131020

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
Plasmodium falciparum	amino acid transporter, putative	0.0132	0.0961	0.5
Schistosoma mansoni	matrix metallopeptidase-9 (M10 family)	0.0024	0.0014	0.0007
Loa Loa (eye worm)	hypothetical protein	0.0132	0.0961	0.1446
Brugia malayi	ecdysone receptor	0.0027	0.0039	0.0047
Brugia malayi	Nuclear hormone receptor-like 1	0.0031	0.0068	0.0091
Schistosoma mansoni	nuclear receptor nhr-48	0.0027	0.0039	0.0031
Loa Loa (eye worm)	hypothetical protein	0.0132	0.0961	0.1446
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0058	0.0309	0.0464
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.0058	0.0309	0.0464
Onchocerca volvulus		0.0031	0.0072	0.0109
Loa Loa (eye worm)	matrixin family protein	0.0025	0.0018	0.0027
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0058	0.0309	0.0453
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0039	0.0059
Brugia malayi	Sodium:neurotransmitter symporter family protein	0.0132	0.0961	0.1436
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0039	0.0059
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0058	0.0309	0.0453
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0024	0.0011	0.0005
Schistosoma mansoni	nuclear hormone receptor	0.0058	0.0309	0.0301
Onchocerca volvulus		0.0776	0.6651	1
Schistosoma mansoni	norepinephrine/norepinephrine transporter	0.0132	0.0961	0.0955
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0058	0.0309	0.0453
Toxoplasma gondii	PAN domain-containing protein	0.0482	0.4057	1
Onchocerca volvulus		0.0031	0.0072	0.0109
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0072	0.0109
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0058	0.0309	0.0301
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0058	0.0309	0.0301
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0058	0.0309	0.0453
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0058	0.0309	0.0464
Schistosoma mansoni	tar DNA-binding protein	0.0044	0.0185	0.0177
Plasmodium falciparum	transporter, putative	0.0132	0.0961	0.5
Loa Loa (eye worm)	hypothetical protein	0.0132	0.0961	0.1446
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0058	0.0309	0.0453
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0149	0.1113	0.1106
Echinococcus granulosus	FTZ F1 alpha	0.0058	0.0309	0.0453
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0058	0.0309	0.0301
Echinococcus granulosus	rho-associated protein kinase 1	0.0176	0.1351	0.2022
Brugia malayi	PAN domain containing protein	0.0031	0.0072	0.0097
Echinococcus granulosus	sodium channel protein	0.0035	0.0108	0.0151
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0058	0.0309	0.0301
Loa Loa (eye worm)	hypothetical protein	0.0058	0.0309	0.0464
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0039	0.0059
Schistosoma mansoni	nuclear receptor	0.0027	0.0039	0.0031
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0072	0.0109
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0027	0.0039	0.0047
Loa Loa (eye worm)	transcription factor SMAD2	0.008	0.0504	0.0757
Echinococcus granulosus	uncharacterized sodium dependent transporter	0.0132	0.0961	0.1436
Loa Loa (eye worm)	hypothetical protein	0.0058	0.0309	0.0464
Brugia malayi	nuclear hormone receptor family member odr-7	0.0027	0.0039	0.0047
Loa Loa (eye worm)	hypothetical protein	0.0149	0.1113	0.1673
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0072	0.0109
Brugia malayi	Protein kinase domain containing protein	0.0546	0.4623	0.6947
Brugia malayi	Nuclear hormone receptor-like 1	0.0058	0.0309	0.0453
Loa Loa (eye worm)	TAR-binding protein	0.0044	0.0185	0.0278
Loa Loa (eye worm)	hypothetical protein	0.0132	0.0961	0.1446
Onchocerca volvulus		0.0031	0.0072	0.0109
Schistosoma mansoni	sodium-dependent neurotransmitter transporter	0.0132	0.0961	0.0955
Brugia malayi	hypothetical protein	0.0031	0.0068	0.0091
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0058	0.0309	0.0464
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0058	0.0309	0.0453
Loa Loa (eye worm)	PAN domain-containing protein	0.0031	0.0072	0.0109
Echinococcus granulosus	ecdysone induced protein 78C	0.0058	0.0309	0.0453
Toxoplasma gondii	Sodium:neurotransmitter symporter family protein	0.0132	0.0961	0.2232
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0058	0.0309	0.0453
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0058	0.0309	0.0453
Schistosoma mansoni	transcription factor LCR-F1	0.0024	0.0011	0.0003
Loa Loa (eye worm)	steroid hormone receptor	0.0058	0.0309	0.0464
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0027	0.0039	0.0047
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0039	0.0059
Brugia malayi	nuclear hormone receptor	0.0027	0.0039	0.0047
Schistosoma mansoni	ecdysone-induced protein 78c (dr-78)	0.0031	0.0068	0.006
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0058	0.0309	0.0464
Brugia malayi	Disintegrin family protein	0.005	0.0239	0.0349
Brugia malayi	hypothetical protein	0.0027	0.0039	0.0047
Onchocerca volvulus		0.0132	0.0961	0.1446
Onchocerca volvulus		0.0031	0.0072	0.0109
Schistosoma mansoni	norepinephrine/norepinephrine transporter	0.0132	0.0961	0.0955
Brugia malayi	hypothetical protein	0.0132	0.0961	0.1436
Schistosoma mansoni	nuclear hormone receptor	0.0027	0.0039	0.0031
Brugia malayi	Sodium:neurotransmitter symporter family protein	0.0132	0.0961	0.1436
Echinococcus granulosus	serotonin transporter	0.0776	0.6651	1
Onchocerca volvulus		0.0027	0.0039	0.0059
Loa Loa (eye worm)	hypothetical protein	0.0132	0.0961	0.1446
Loa Loa (eye worm)	hypothetical protein	0.0033	0.0092	0.0138
Schistosoma mansoni	sodium/chloride dependent transporter	0.0132	0.0961	0.0955
Schistosoma mansoni	hypothetical protein	0.0113	0.08	0.0793
Brugia malayi	nuclear receptor subfamily 1, group D, member 1, putative	0.0027	0.0039	0.0047
Echinococcus granulosus	matrix metallopeptidase 7 M10 family	0.0037	0.0129	0.0183
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0058	0.0309	0.0453
Entamoeba histolytica	hypothetical protein	0.0024	0.0011	0.5
Toxoplasma gondii	hypothetical protein	0.0132	0.0961	0.2232
Schistosoma mansoni	tar DNA-binding protein	0.0044	0.0185	0.0177
Schistosoma mansoni	sodium/chloride dependent transporter	0.0132	0.0965	0.0958
Brugia malayi	RNA recognition motif domain containing protein	0.0044	0.0185	0.0267
Loa Loa (eye worm)	AGC/DMPK/ROCK protein kinase	0.0546	0.4623	0.695
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0058	0.0309	0.0453
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0058	0.0309	0.0453
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0058	0.0309	0.0453
Schistosoma mansoni	sodium-dependent neurotransmitter transporter	0.0132	0.0961	0.0955
Onchocerca volvulus	Protein ultraspiracle homolog	0.0058	0.0309	0.0464
Echinococcus multilocularis	matrix metallopeptidase 7 (M10 family)	0.0037	0.0129	0.0183
Echinococcus multilocularis	sodium and chloride dependent glycine	0.0132	0.0961	0.1436
Brugia malayi	PAN domain containing protein	0.0031	0.0072	0.0097
Echinococcus multilocularis	retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha	0.0027	0.0039	0.0047
Echinococcus granulosus	biogenic amine 5HT receptor	0.0466	0.3916	0.5883
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0031	0.0068	0.006
Loa Loa (eye worm)	hypothetical protein	0.0776	0.6651	1
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0027	0.0039	0.0047
Schistosoma mansoni	tar DNA-binding protein	0.0044	0.0185	0.0177
Loa Loa (eye worm)	hypothetical protein	0.0058	0.0309	0.0464
Brugia malayi	Steroid receptor seven-up type 2	0.0058	0.0309	0.0453
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0058	0.0309	0.0453
Treponema pallidum	sodium- and chloride- dependent transporter	0.0776	0.6651	0.5
Loa Loa (eye worm)	nuclear hormone receptor	0.0027	0.0039	0.0059
Echinococcus multilocularis	serotonin receptor	0.0149	0.1113	0.1663
Brugia malayi	PAN domain containing protein	0.0031	0.0072	0.0097
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0072	0.0109
Echinococcus multilocularis	biogenic amine (5HT) receptor	0.0466	0.3916	0.5883
Brugia malayi	PAN domain containing protein	0.0031	0.0072	0.0097
Echinococcus granulosus	nuclear receptor nhr 48	0.0027	0.0039	0.0047
Schistosoma mansoni	nuclear hormone receptor	0.0027	0.0039	0.0031
Loa Loa (eye worm)	MH2 domain-containing protein	0.008	0.0504	0.0757
Schistosoma mansoni	hypothetical protein	0.0024	0.0011	0.0003
Brugia malayi	PAN domain containing protein	0.0031	0.0072	0.0097
Brugia malayi	nuclear receptor RXR	0.0031	0.0068	0.0091
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0058	0.0309	0.0464
Onchocerca volvulus		0.0031	0.0072	0.0109
Brugia malayi	hypothetical protein	0.0027	0.0039	0.0047
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0058	0.0309	0.0453
Onchocerca volvulus		0.0031	0.0072	0.0109
Echinococcus multilocularis	Blood coagulation inhibitor, Disintegrin	0.0033	0.0092	0.0127
Echinococcus multilocularis	sodium dependent neurotransmitter transporter	0.0132	0.0961	0.1436
Plasmodium vivax	amine transporter, putative	0.0132	0.0961	0.5
Loa Loa (eye worm)	PAN domain-containing protein	0.0031	0.0072	0.0109
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0068	0.0102
Brugia malayi	Sodium:neurotransmitter symporter family protein	0.0776	0.6651	1
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0039	0.0059
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0044	0.0185	0.0278
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0058	0.0309	0.0453
Echinococcus multilocularis	nuclear receptor subfamily 4 group A	0.0027	0.0039	0.0047
Schistosoma mansoni	tar DNA-binding protein	0.0044	0.0185	0.0177
Schistosoma mansoni	sodium-dependent neurotransmitter transporter	0.0132	0.0961	0.0955
Echinococcus multilocularis	uncharacterized sodium dependent transporter	0.0132	0.0961	0.1436
Schistosoma mansoni	thyroid hormone receptor	0.0058	0.0309	0.0301
Schistosoma mansoni	hepatocyte nuclear factor 4-alpha (hnf-4-alpha)	0.0027	0.0039	0.0031
Schistosoma mansoni	RAR-like nuclear receptor	0.0058	0.0309	0.0301
Loa Loa (eye worm)	norepinephrine transporter	0.0776	0.6651	1
Brugia malayi	orphan nuclear receptor NR2E1	0.0027	0.0039	0.0047
Schistosoma mansoni	retinoic acid receptor RXR	0.0058	0.0309	0.0301
Brugia malayi	nuclear hormone receptor family member nhr-6	0.0027	0.0039	0.0047
Onchocerca volvulus	Bile acid receptor homolog	0.0058	0.0309	0.0464
Brugia malayi	Sodium:neurotransmitter symporter family protein	0.0132	0.0961	0.1436
Brugia malayi	nuclear receptor NHR-88	0.0027	0.0039	0.0047
Brugia malayi	hypothetical protein	0.0024	0.0011	0.0005
Loa Loa (eye worm)	serotonin transporter b	0.0776	0.6651	1
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0058	0.0309	0.0453
Entamoeba histolytica	hypothetical protein	0.0024	0.0011	0.5
Onchocerca volvulus	Nuclear receptor subfamily 6 group A member 1 homolog	0.0027	0.0039	0.0059
Brugia malayi	RNA binding protein	0.0044	0.0185	0.0267
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0058	0.0309	0.0453
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0072	0.0109
Echinococcus granulosus	tar DNA binding protein	0.0044	0.0185	0.0267
Brugia malayi	PAN domain containing protein	0.0031	0.0072	0.0097
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0027	0.0039	0.0047
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0058	0.0309	0.0453
Entamoeba histolytica	hypothetical protein	0.0024	0.0011	0.5
Toxoplasma gondii	Sodium:neurotransmitter symporter family protein	0.0132	0.0961	0.2232
Loa Loa (eye worm)	Sodium:neurotransmitter symporter family protein	0.0132	0.0961	0.1446
Brugia malayi	nuclear receptor RXR	0.0027	0.0039	0.0047
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0058	0.0309	0.0464
Schistosoma mansoni	sodium/chloride dependent neurotransmitter transporter	0.0132	0.0961	0.0955
Brugia malayi	nuclear receptor NHR-67	0.0027	0.0039	0.0047
Loa Loa (eye worm)	hypothetical protein	0.0776	0.6651	1
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0039	0.0059
Loa Loa (eye worm)	solute carrier family 6 member 4	0.0776	0.6651	1
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0039	0.0059
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0039	0.0059
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0058	0.0309	0.0453
Schistosoma mansoni	sodium/chloride dependent neurotransmitter transporter	0.0132	0.0961	0.0955
Echinococcus multilocularis	rho associated protein kinase	0.0176	0.1351	0.2022
Echinococcus multilocularis	nuclear receptor nhr 48	0.0027	0.0039	0.0047
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0039	0.0059
Echinococcus multilocularis	ecdysone induced protein 78C	0.0058	0.0309	0.0453
Echinococcus multilocularis	tar DNA binding protein	0.0044	0.0185	0.0267
Echinococcus multilocularis	disintegrin and metalloproteinase	0.005	0.0239	0.0349
Loa Loa (eye worm)	hypothetical protein	0.0132	0.0961	0.1446
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0058	0.0309	0.0301
Schistosoma mansoni	sodium/chloride dependent transporter	0.0776	0.6651	0.6649
Loa Loa (eye worm)	RNA binding protein	0.0044	0.0185	0.0278
Schistosoma mansoni	thyroid hormone receptor	0.0058	0.0309	0.0301
Echinococcus granulosus	sodium:chloride dependent neurotransmitter	0.0132	0.0961	0.1436
Brugia malayi	tailless protein	0.0027	0.0039	0.0047
Echinococcus granulosus	geminin	0.0113	0.08	0.1192
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0039	0.0059
Brugia malayi	PAN domain containing protein	0.0031	0.0072	0.0097
Echinococcus granulosus	sodium and chloride dependent glycine	0.0132	0.0961	0.1436
Brugia malayi	steroid hormone receptor	0.0058	0.0309	0.0453
Schistosoma mansoni	hypothetical protein	0.0113	0.08	0.0793
Echinococcus multilocularis	sodium channel protein	0.0035	0.0108	0.0151
Brugia malayi	MH2 domain containing protein	0.008	0.0504	0.0747
Onchocerca volvulus		0.0176	0.1351	0.2031
Leishmania major	calcium channel protein, putative,ion transporter, putative	0.0035	0.0108	0.5
Echinococcus granulosus	nuclear receptor subfamily 4 group A	0.0027	0.0039	0.0047
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0068	0.0102
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0058	0.0309	0.0453
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0072	0.0109
Loa Loa (eye worm)	hypothetical protein	0.0058	0.0309	0.0464
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0039	0.0059
Loa Loa (eye worm)	PAN domain-containing protein	0.0031	0.0072	0.0109
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0068	0.0102
Schistosoma mansoni	coup transcription factor	0.0058	0.0309	0.0301
Schistosoma mansoni	nuclear receptor	0.0027	0.0039	0.0031
Schistosoma mansoni	biogenic amine (5HT) receptor	0.0466	0.3916	0.3912
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0058	0.0309	0.0453
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0024	0.0011	0.0005
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0039	0.0059
Onchocerca volvulus		0.0027	0.0039	0.0059
Onchocerca volvulus		0.0031	0.0072	0.0109
Echinococcus multilocularis	serotonin transporter	0.0776	0.6651	1
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0068	0.0102
Toxoplasma gondii	hypothetical protein	0.0132	0.0961	0.2232
Chlamydia trachomatis	Ssodium-dependent amino acid transporter	0.0132	0.0961	0.5
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0058	0.0309	0.0453
Toxoplasma gondii	PAN domain-containing protein	0.0482	0.4057	1
Brugia malayi	photoreceptor-specific nuclear receptor	0.0058	0.0309	0.0453
Echinococcus multilocularis	sodium:chloride dependent neurotransmitter	0.0132	0.0961	0.1436
Brugia malayi	nuclear receptor NHR-88	0.0058	0.0309	0.0453
Onchocerca volvulus		0.0175	0.1348	0.2026
Echinococcus granulosus	thyroid hormone receptor alpha	0.0027	0.0039	0.0047
Brugia malayi	ecdysteroid receptor	0.0058	0.0309	0.0453
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0058	0.0309	0.0453
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0039	0.0059
Echinococcus granulosus	uncharacterized sodium dependent transporter	0.0132	0.0961	0.1436
Loa Loa (eye worm)	nuclear receptor nhr-7B	0.0027	0.0039	0.0059
Schistosoma mansoni	sodium-dependent amino acid transporter	0.0132	0.0961	0.0955
Plasmodium vivax	hypothetical protein, conserved	0.0132	0.0961	0.5
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0072	0.0109
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0027	0.0039	0.0047
Echinococcus granulosus	voltage gated sodium channel Nav1 alpha subunit	0.0035	0.0108	0.0151
Echinococcus multilocularis	serotonin receptor	0.0149	0.1113	0.1663
Brugia malayi	nuclear hormone receptor	0.0058	0.0309	0.0453
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0058	0.0309	0.0301
Entamoeba histolytica	hypothetical protein	0.0024	0.0011	0.5
Brugia malayi	PAN domain containing protein	0.0031	0.0072	0.0097
Echinococcus granulosus	biogenic amine 5HT receptor	0.0149	0.1113	0.1663
Echinococcus granulosus	disintegrin and metalloproteinase	0.005	0.0239	0.0349
Loa Loa (eye worm)	hypothetical protein	0.0058	0.0309	0.0464
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0027	0.0039	0.0047
Brugia malayi	PAN domain containing protein	0.0031	0.0072	0.0097
Loa Loa (eye worm)	nuclear receptor NHR-67	0.0027	0.0039	0.0059
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0058	0.0309	0.0464
Echinococcus granulosus	nuclear receptor subfamily 1 group D	0.0031	0.0068	0.0091
Brugia malayi	Nuclear hormone receptor E75	0.0027	0.0039	0.0047
Loa Loa (eye worm)	nuclear hormone receptor-like 1	0.0031	0.0068	0.0102
Schistosoma mansoni	norepinephrine/norepinephrine transporter	0.0776	0.6651	0.6649
Brugia malayi	Sodium:neurotransmitter symporter family protein 1, putative	0.0132	0.0961	0.1436
Onchocerca volvulus		0.0132	0.0961	0.1446
Brugia malayi	Nuclear hormone receptor E75	0.0027	0.0039	0.0047
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0068	0.0102
Onchocerca volvulus		0.0058	0.0309	0.0464
Brugia malayi	TAR-binding protein	0.0044	0.0185	0.0267
Loa Loa (eye worm)	hypothetical protein	0.0058	0.0309	0.0464
Echinococcus granulosus	Blood coagulation inhibitor Disintegrin	0.0033	0.0092	0.0127
Echinococcus multilocularis	sodium and chloride dependent glycine	0.0132	0.0961	0.1436
Brugia malayi	Nuclear hormone receptor-like 1	0.0031	0.0068	0.0091
Loa Loa (eye worm)	hypothetical protein	0.0776	0.6651	1
Onchocerca volvulus		0.0031	0.0072	0.0109
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0058	0.0309	0.0453
Toxoplasma gondii	Sodium:neurotransmitter symporter family protein	0.0132	0.0961	0.2232
Loa Loa (eye worm)	hypothetical protein	0.0132	0.0961	0.1446
Onchocerca volvulus		0.0031	0.0072	0.0109
Brugia malayi	hypothetical protein	0.0031	0.0068	0.0091
Loa Loa (eye worm)	Sodium:neurotransmitter symporter family protein	0.0132	0.0961	0.1446
Echinococcus multilocularis	FTZ F1 alpha	0.0058	0.0309	0.0453
Onchocerca volvulus		0.0031	0.0072	0.0109
Loa Loa (eye worm)	hypothetical protein	0.0058	0.0309	0.0464
Onchocerca volvulus	Nuclear receptor subfamily 6 group A member 1 homolog	0.0027	0.0039	0.0059
Loa Loa (eye worm)	hypothetical protein	0.0149	0.1113	0.1673
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0058	0.0309	0.0453
Loa Loa (eye worm)	hypothetical protein	0.0058	0.0309	0.0464
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0058	0.0309	0.0301
Echinococcus multilocularis	geminin	0.0113	0.08	0.1192
Schistosoma mansoni	sodium/chloride dependent neurotransmitter transporter	0.0132	0.0961	0.0955
Loa Loa (eye worm)	disintegrin family protein	0.0036	0.0119	0.0179
Echinococcus granulosus	sodium and chloride dependent glycine	0.0132	0.0961	0.1436
Echinococcus multilocularis	nuclear receptor subfamily 1 group D	0.0031	0.0068	0.0091
Onchocerca volvulus		0.0031	0.0072	0.0109
Echinococcus granulosus	sodium dependent neurotransmitter transporter	0.0132	0.0961	0.1436
Loa Loa (eye worm)	PAN domain-containing protein	0.0031	0.0072	0.0109
Schistosoma mansoni	serine/threonine protein kinase	0.0176	0.1351	0.1345
Loa Loa (eye worm)	PAN domain-containing protein	0.0031	0.0072	0.0109
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0058	0.0309	0.0453
Onchocerca volvulus		0.0132	0.0961	0.1446
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0058	0.0309	0.0453
Schistosoma mansoni	dihydroceramide desaturase	0.005	0.0239	0.0232
Brugia malayi	conserved hypotetical protein	0.0027	0.0039	0.0047
Schistosoma mansoni	zinc finger protein	0.0027	0.0039	0.0031
Schistosoma mansoni	tar DNA-binding protein	0.0044	0.0185	0.0177
Loa Loa (eye worm)	DR-78	0.0027	0.0039	0.0059
Brugia malayi	PAN domain containing protein	0.0031	0.0072	0.0097
Brugia malayi	Matrixin family protein	0.0025	0.0018	0.0016

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 14900 nM	BindingDB_Patents: Kinase Inhibition Assay. Inhibition of ROCK2 activity was determined using the IMAP Screening Express Kit (Molecular Devices product number #8073). ROCK2 kinase (UpstateChemicon #14-451) and Flourescein tagged substrate peptide Fl-AKRRRLSSLRA (Molecular Devices product number R7184).	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.

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External resources for this compound

ChEMBL: CHEMBL3689476

Bibliographic References

No literature references available for this target.

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Detailed information for compound 2001689