TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 415.488 | Formula: C24H25N5O2
H donors: 2 H acceptors: 3 LogP: 4.41 Rotable bonds: 7
Rule of 5 violations (Lipinski): 1
SMILES: CC(=O)Nc1nccc(c1)Oc1ccc2c(c1)nc(n2C)Nc1cccc(c1)C(C)C
InChi: 1S/C24H25N5O2/c1-15(2)17-6-5-7-18(12-17)27-24-28-21-13-19(8-9-22(21)29(24)4)31-20-10-11-25-23(14-20)26-16(3)30/h5-15H,1-4H3,(H,27,28)(H,25,26,30)
InChiKey: CGKCRNMLFZNYKA-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	B-Raf proto-oncogene, serine/threonine kinase	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Schistosoma mansoni	serine/threonine protein kinase	Get druggable targets OG5_130459	All targets in OG5_130459
Schistosoma japonicum	ko:K04365 B-Raf proto-oncogene serine/threonine-protein kinase, putative	Get druggable targets OG5_130459	All targets in OG5_130459
Brugia malayi	Raf kinase	Get druggable targets OG5_130459	All targets in OG5_130459
Loa Loa (eye worm)	raf kinase	Get druggable targets OG5_130459	All targets in OG5_130459
Loa Loa (eye worm)	TKL/RAF/RAF protein kinase	Get druggable targets OG5_130459	All targets in OG5_130459
Echinococcus granulosus	raf serine:threonine protein kinase	Get druggable targets OG5_130459	All targets in OG5_130459
Echinococcus multilocularis	raf serine:threonine protein kinase	Get druggable targets OG5_130459	All targets in OG5_130459

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
Brugia malayi	hypothetical protein	0.0044	0.0037	0.0144
Onchocerca volvulus	Tyrosine kinase homolog	0.0436	0.0711	0.2789
Brugia malayi	Fibronectin type III domain containing protein	0.0044	0.0037	0.0144
Mycobacterium tuberculosis	Putative ferredoxin reductase	0.0106	0.0144	0.0492
Brugia malayi	beta-lactamase family protein	0.0264	0.0415	0.1626
Schistosoma mansoni	growth factor receptor-bound protein	0.0027	0.0008	0.0008
Echinococcus granulosus	tyrosine protein kinase Btk29A	0.0036	0.0023	0.0023
Echinococcus granulosus	tyrosine protein kinase Src64B	0.0106	0.0144	0.0144
Schistosoma mansoni	nck2/grb4	0.0027	0.0008	0.0008
Loa Loa (eye worm)	transcription factor SMAD2	0.0239	0.0372	0.1458
Schistosoma mansoni	survival motor neuron protein	0.0201	0.0307	0.0307
Brugia malayi	Peroxidasin	0.0023	0.0001	0.0002
Echinococcus granulosus	tyrosine protein kinase HCK	0.008	0.0098	0.0098
Mycobacterium tuberculosis	Probable dehydrogenase	0.0106	0.0144	0.0492
Loa Loa (eye worm)	hypothetical protein	0.0264	0.0415	0.1626
Loa Loa (eye worm)	glutathione reductase	0.0047	0.0042	0.0161
Echinococcus granulosus	c src tyrosine kinase	0.0036	0.0023	0.0023
Mycobacterium tuberculosis	Conserved protein	0.0264	0.0415	0.144
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0001	0.0001
Loa Loa (eye worm)	hypothetical protein	0.0149	0.0217	0.085
Echinococcus multilocularis	tyrosine protein kinase lyn lyn a protein tyrosine kinase lymphocyte specific protein tyrosine kinase	0.0106	0.0144	0.0144
Loa Loa (eye worm)	immunoglobulin I-set domain-containing protein	0.0023	0.0001	0.0001
Schistosoma mansoni	nephrin	0.0054	0.0054	0.0054
Echinococcus multilocularis	tyrosine protein kinase Src42A	0.0084	0.0106	0.0105
Entamoeba histolytica	hypothetical protein	0.0149	0.0218	1
Brugia malayi	hypothetical protein	0.0862	0.1443	0.5667
Loa Loa (eye worm)	hypothetical protein	0.0044	0.0037	0.0144
Echinococcus granulosus	neurotracting:lsamp:neurotrimin:obcam	0.0057	0.0059	0.0059
Echinococcus multilocularis	raf serine:threonine protein kinase	0.0269	0.0425	0.0424
Loa Loa (eye worm)	hypothetical protein	0.0149	0.0218	0.0854
Schistosoma mansoni	tyrosine kinase	0.0023	0.0001	0.0001
Echinococcus granulosus	twitchin	0.0054	0.0054	0.0054
Loa Loa (eye worm)	hypothetical protein	0.0264	0.0415	0.1626
Trypanosoma cruzi	hypothetical protein, conserved	0.0264	0.0415	1
Mycobacterium ulcerans	fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE	0.0264	0.0415	1
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0001	0.0002
Echinococcus multilocularis	neuroglian	0.0054	0.0054	0.0054
Schistosoma mansoni	vesicular amine transporter	0.0044	0.0037	0.0037
Onchocerca volvulus		0.1504	0.2547	1
Onchocerca volvulus		0.1504	0.2547	1
Loa Loa (eye worm)	raf kinase	0.026	0.0409	0.1604
Brugia malayi	LBP / BPI / CETP family, C-terminal domain containing protein	0.0862	0.1443	0.5667
Loa Loa (eye worm)	MH2 domain-containing protein	0.0239	0.0372	0.1458
Loa Loa (eye worm)	hypothetical protein	0.0862	0.1443	0.5667
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0149	0.0218	0.0218
Loa Loa (eye worm)	hypothetical protein	0.0044	0.0037	0.0144
Loa Loa (eye worm)	thioredoxin reductase	0.0047	0.0042	0.0161
Toxoplasma gondii	thioredoxin reductase	0.0047	0.0042	0.0912
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0264	0.0415	0.0415
Echinococcus multilocularis	guanine nucleotide exchange factor VAV2	0.0023	0.0001	0.0000035761
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0001	0.0001
Brugia malayi	hypothetical protein	0.0149	0.0218	0.0854
Plasmodium falciparum	thioredoxin reductase	0.0047	0.0042	1
Echinococcus multilocularis	tyrosine protein kinase lyn tyrosine protein kinase blk	0.0106	0.0144	0.0144
Echinococcus multilocularis	tyrosine protein kinase HCK	0.008	0.0098	0.0098
Brugia malayi	SRC-1	0.0106	0.0144	0.0565
Entamoeba histolytica	hypothetical protein	0.0149	0.0218	1
Trichomonas vaginalis	conserved hypothetical protein	0.0642	0.1065	1
Echinococcus multilocularis	tyrosine protein kinase Fgr	0.0106	0.0144	0.0144
Brugia malayi	LBP / BPI / CETP family, C-terminal domain containing protein	0.1504	0.2547	1
Echinococcus granulosus	guanine nucleotide exchange factor VAV2	0.0023	0.0001	0.0000035761
Brugia malayi	AMP-binding enzyme family protein	0.0025	0.0004	0.0013
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.0093	0.0122	0.0121
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0149	0.0218	0.0218
Plasmodium vivax	thioredoxin reductase, putative	0.0047	0.0042	0.0912
Loa Loa (eye worm)	hypothetical protein	0.0067	0.0076	0.0298
Loa Loa (eye worm)	hypothetical protein	0.0642	0.1065	0.4179
Trypanosoma cruzi	trypanothione reductase, putative	0.0047	0.0042	0.0912
Mycobacterium tuberculosis	Probable membrane NADH dehydrogenase NdhA	0.0106	0.0144	0.0492
Brugia malayi	LBP / BPI / CETP family, N-terminal domain containing protein	0.1504	0.2547	1
Echinococcus multilocularis	basement membrane specific heparan sulfate	0.0049	0.0046	0.0045
Brugia malayi	hypothetical protein	0.0149	0.0218	0.0854
Echinococcus granulosus	N chimaerin	0.0023	0.0001	0.0000035761
Trypanosoma brucei	trypanothione reductase	0.0047	0.0042	0.0912
Echinococcus multilocularis	tyrosine protein kinase Abl	0.0036	0.0023	0.0023
Loa Loa (eye worm)	hypothetical protein	0.0044	0.0037	0.0144
Schistosoma mansoni	neuroglian	0.0023	0.0001	0.0001
Brugia malayi	beta-lactamase family protein	0.0264	0.0415	0.1626
Schistosoma mansoni	tyrosine kinase	0.0036	0.0023	0.0023
Echinococcus granulosus	raf serine:threonine protein kinase	0.0269	0.0425	0.0424
Echinococcus granulosus	tyrosine protein kinase Src42A	0.0084	0.0106	0.0105
Loa Loa (eye worm)	TK protein kinase	0.008	0.0098	0.0383
Plasmodium falciparum	glutathione reductase	0.0047	0.0042	1
Onchocerca volvulus		0.0862	0.1443	0.5667
Echinococcus multilocularis	tumor protein p63	0.1016	0.1708	0.1707
Mycobacterium tuberculosis	Probable NADH dehydrogenase Ndh	0.0106	0.0144	0.0492
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0044	0.0037	0.0144
Onchocerca volvulus		0.1504	0.2547	1
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0025	0.0004	0.0156
Onchocerca volvulus		0.0417	0.0678	0.266
Echinococcus granulosus	tyrosine protein kinase Lyn	0.0106	0.0144	0.0144
Schistosoma mansoni	septate junction protein	0.0023	0.0001	0.0001
Echinococcus granulosus	survival motor neuron protein 1	0.0986	0.1656	0.1656
Toxoplasma gondii	ABC1 family protein	0.0264	0.0415	1
Schistosoma mansoni	receptor tyrosine phosphatase type r2a	0.0023	0.0001	0.0001
Mycobacterium ulcerans	lipase LipD	0.0264	0.0415	1
Loa Loa (eye worm)	hypothetical protein	0.0057	0.0059	0.023
Brugia malayi	Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative	0.0264	0.0415	0.1626
Echinococcus granulosus	thioredoxin glutathione reductase	0.0047	0.0042	0.0041
Schistosoma mansoni	hypothetical protein	0.0201	0.0307	0.0307
Trypanosoma brucei	hypothetical protein, conserved	0.0264	0.0415	1
Schistosoma mansoni	neurotracting/lsamp/neurotrimin/obcam related cell adhesion molecule	0.0023	0.0001	0.0001
Schistosoma mansoni	growth factor receptor-bound protein	0.0027	0.0008	0.0008
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0001	0.0001
Schistosoma mansoni	titin	0.0023	0.0001	0.0001
Schistosoma mansoni	hypothetical protein	0.0149	0.0218	0.0218
Loa Loa (eye worm)	TK protein kinase	0.0093	0.0122	0.0475
Schistosoma mansoni	cellular tumor antigen P53	0.0149	0.0217	0.0217
Echinococcus multilocularis	N chimaerin	0.0023	0.0001	0.0000035761
Echinococcus multilocularis	roundabout 2	0.0067	0.0076	0.0076
Schistosoma mansoni	proto-oncogene tyrosine-protein kinase src	0.0036	0.0023	0.0023
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0001	0.0001
Mycobacterium tuberculosis	NAD(P)H quinone reductase LpdA	0.0118	0.0165	0.0564
Schistosoma mansoni	proto-oncogene tyrosine-protein kinase abl1	0.0027	0.0008	0.0008
Loa Loa (eye worm)	hypothetical protein	0.0044	0.0037	0.0144
Echinococcus multilocularis	tyrosine protein kinase Src42A	0.0106	0.0144	0.0144
Loa Loa (eye worm)	hypothetical protein	0.0264	0.0415	0.1626
Mycobacterium tuberculosis	Probable conserved lipoprotein	0.0264	0.0415	0.144
Brugia malayi	Variant SH3 domain containing protein	0.0027	0.0008	0.0028
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0004	0.0013
Mycobacterium leprae	DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE	0.0118	0.0165	0.3917
Echinococcus granulosus	tyrosine protein kinase Blk	0.0093	0.0122	0.0121
Mycobacterium tuberculosis	Probable esterase/lipase LipP	0.0264	0.0415	0.144
Echinococcus multilocularis	Immunoglobulin	0.0044	0.0037	0.0037
Loa Loa (eye worm)	hypothetical protein	0.0642	0.1065	0.4179
Onchocerca volvulus		0.0149	0.0218	0.0854
Mycobacterium leprae	conserved hypothetical protein	0.0264	0.0415	1
Onchocerca volvulus		0.0149	0.0217	0.085
Loa Loa (eye worm)	hypothetical protein	0.0027	0.0008	0.0028
Echinococcus multilocularis	NCK adaptor protein	0.0027	0.0008	0.0007
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0023	0.0001	0.0001
Loa Loa (eye worm)	hypothetical protein	0.0986	0.1656	0.6504
Schistosoma mansoni	septate junction protein	0.0023	0.0001	0.0001
Echinococcus granulosus	tyrosine kinase\|tyrosine protein kinase Fyn	0.0093	0.0122	0.0121
Echinococcus multilocularis	microtubule associated protein 2	0.584	1	1
Loa Loa (eye worm)	hypothetical protein	0.0862	0.1443	0.5667
Loa Loa (eye worm)	beta-lactamase	0.0264	0.0415	0.1626
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0483	0.0791	0.3105
Brugia malayi	Sex muscle abnormal protein 5	0.0027	0.0008	0.0028
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0023	0.0001	0.0001
Echinococcus multilocularis	c src tyrosine kinase	0.0036	0.0023	0.0023
Onchocerca volvulus		0.0264	0.0415	0.1626
Echinococcus multilocularis	tyrosine protein kinase Blk	0.0093	0.0122	0.0121
Plasmodium vivax	glutathione reductase, putative	0.0047	0.0042	0.0912
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0023	0.0001	0.0001
Brugia malayi	Prion-like-	0.0023	0.0001	0.0001
Echinococcus multilocularis	tyrosine protein kinase Src64B	0.0106	0.0144	0.0144
Echinococcus granulosus	proto oncogene tyrosine protein kinase LCK	0.0106	0.0144	0.0144
Loa Loa (eye worm)	beta-LACTamase domain containing family member	0.0264	0.0415	0.1626
Loa Loa (eye worm)	hypothetical protein	0.0264	0.0415	0.1626
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0004	0.0013
Loa Loa (eye worm)	hypothetical protein	0.0862	0.1443	0.5667
Onchocerca volvulus		0.0025	0.0004	0.0013
Loa Loa (eye worm)	SRC-1	0.0106	0.0144	0.0565
Schistosoma mansoni	cell adhesion molecule	0.0023	0.0001	0.0001
Entamoeba histolytica	hypothetical protein	0.0149	0.0218	1
Loa Loa (eye worm)	variant SH3 domain-containing protein	0.0027	0.0008	0.0028
Schistosoma mansoni	serine/threonine protein kinase	0.0269	0.0425	0.0425
Brugia malayi	Thioredoxin reductase	0.0047	0.0042	0.0161
Loa Loa (eye worm)	sex muscle abnormal protein 5	0.0027	0.0008	0.0028
Echinococcus granulosus	tumor protein p63	0.1016	0.1708	0.1707
Schistosoma mansoni	Neurotrimin precursor (hNT)	0.0044	0.0037	0.0037
Schistosoma mansoni	tyrosine kinase	0.0036	0.0023	0.0023
Onchocerca volvulus		0.1504	0.2547	1
Loa Loa (eye worm)	TKL/RAF/RAF protein kinase	0.0156	0.023	0.0901
Mycobacterium tuberculosis	Conserved protein	0.0264	0.0415	0.144
Mycobacterium tuberculosis	Probable esterase LipL	0.0264	0.0415	0.144
Mycobacterium leprae	PROBABLE NADH DEHYDROGENASE NDH	0.0106	0.0144	0.342
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0023	0.0001	0.0001
Schistosoma mansoni	roundabout	0.0023	0.0001	0.0001
Brugia malayi	LBP/BPI	0.0642	0.1065	0.4179
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0023	0.0001	0.0001
Mycobacterium tuberculosis	NADPH-dependent mycothiol reductase Mtr	0.0047	0.0042	0.0132
Echinococcus granulosus	tyrosine protein kinase Fyn	0.0106	0.0144	0.0144
Mycobacterium tuberculosis	Possible conserved lipoprotein LpqK	0.0264	0.0415	0.144
Echinococcus granulosus	tyrosine protein kinase Fyn	0.0106	0.0144	0.0144
Echinococcus granulosus	macrophage colony stimulating factor 1 receptor	0.0676	0.1123	0.1123
Onchocerca volvulus		0.0264	0.0415	0.1626
Brugia malayi	glutathione reductase	0.0047	0.0042	0.0161
Loa Loa (eye worm)	immunoglobulin I-set domain-containing protein	0.0023	0.0001	0.0001
Brugia malayi	LBP / BPI / CETP family, N-terminal domain containing protein	0.1504	0.2547	1
Echinococcus multilocularis	proto oncogene tyrosine protein kinase LCK	0.0106	0.0144	0.0144
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.0106	0.0144	0.0144
Mycobacterium tuberculosis	Probable lipase LipE	0.0264	0.0415	0.144
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0004	0.0013
Mycobacterium tuberculosis	Probable lipase LipD	0.0264	0.0415	0.144
Echinococcus multilocularis	beta LACTamase domain containing family member	0.0264	0.0415	0.0414
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.0106	0.0144	0.0144
Schistosoma mansoni	defective proboscis extension response (dpr)-related	0.0044	0.0037	0.0037
Mycobacterium tuberculosis	Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB	0.0106	0.0144	0.0492
Loa Loa (eye worm)	hypothetical protein	0.0264	0.0415	0.1626
Schistosoma mansoni	vav2	0.0023	0.0001	0.0001
Entamoeba histolytica	acyl-coA synthetase, putative	0.0025	0.0004	0.0156
Leishmania major	trypanothione reductase	0.0047	0.0042	0.0918
Schistosoma mansoni	tyrosine kinase	0.0106	0.0144	0.0144
Loa Loa (eye worm)	hypothetical protein	0.0044	0.0037	0.0144
Trypanosoma cruzi	hypothetical protein, conserved	0.0264	0.0415	1
Mycobacterium leprae	Probable lipase LipE	0.0264	0.0415	1
Echinococcus multilocularis	tyrosine protein kinase Btk29A	0.0036	0.0023	0.0023
Loa Loa (eye worm)	hypothetical protein	0.0862	0.1443	0.5667
Echinococcus granulosus	beta LACTamase domain containing family member	0.0264	0.0415	0.0414
Echinococcus granulosus	3'partial\|tyrosine protein kinase Fgr	0.0106	0.0144	0.0144
Schistosoma mansoni	tyrosine kinase	0.0106	0.0144	0.0144
Entamoeba histolytica	hypothetical protein	0.0149	0.0218	1
Mycobacterium tuberculosis	Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras	0.0118	0.0165	0.0564
Loa Loa (eye worm)	hypothetical protein	0.0044	0.0037	0.0144
Brugia malayi	Raf kinase	0.026	0.0409	0.1604
Echinococcus granulosus	growth factor receptor bound protein 2	0.0027	0.0008	0.0007
Brugia malayi	beta-lactamase	0.0264	0.0415	0.1626
Schistosoma mansoni	cell adhesion molecule	0.0057	0.0059	0.0059
Schistosoma mansoni	transcription factor LCR-F1	0.0149	0.0218	0.0218
Echinococcus multilocularis	tyrosine protein kinase Fyn	0.0106	0.0144	0.0144
Schistosoma mansoni	tyrosine kinase	0.0032	0.0016	0.0016
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0001	0.0001
Schistosoma mansoni	chimerin-related rho-gtpase-activating protein	0.0023	0.0001	0.0001
Loa Loa (eye worm)	CAMK/MLCK protein kinase	0.0023	0.0001	0.0001
Brugia malayi	hypothetical protein	0.0025	0.0004	0.0014
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0023	0.0001	0.0001
Echinococcus multilocularis	Immunoglobulin	0.0044	0.0037	0.0037
Echinococcus granulosus	defective proboscis extension response	0.0044	0.0037	0.0037
Echinococcus multilocularis	growth factor receptor bound protein 2	0.0027	0.0008	0.0007
Loa Loa (eye worm)	hypothetical protein	0.0067	0.0076	0.0298
Leishmania major	hypothetical protein, conserved	0.0025	0.0004	0.0006
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0001	0.0001
Loa Loa (eye worm)	hypothetical protein	0.0862	0.1443	0.5667
Loa Loa (eye worm)	immunoglobulin I-set domain-containing protein	0.0023	0.0001	0.0001
Loa Loa (eye worm)	hypothetical protein	0.0264	0.0415	0.1626
Brugia malayi	protein-tyrosine kinase	0.0093	0.0122	0.0475
Mycobacterium tuberculosis	Conserved protein	0.0264	0.0415	0.144
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.1684	0.2856	1
Brugia malayi	hypothetical protein	0.0862	0.1443	0.5667
Brugia malayi	LBP / BPI / CETP family, C-terminal domain containing protein	0.0862	0.1443	0.5667
Onchocerca volvulus		0.0642	0.1065	0.4179
Echinococcus granulosus	tyrosine kinase	0.0093	0.0122	0.0121
Onchocerca volvulus		0.0862	0.1443	0.5667
Brugia malayi	Variant SH3 domain containing protein	0.0027	0.0008	0.0028
Brugia malayi	LBP / BPI / CETP family, C-terminal domain containing protein	0.0862	0.1443	0.5667
Onchocerca volvulus		0.1504	0.2547	1
Brugia malayi	hypothetical protein	0.0642	0.1065	0.4179
Mycobacterium tuberculosis	Probable hydrolase	0.0264	0.0415	0.144
Onchocerca volvulus		0.1504	0.2547	1
Entamoeba histolytica	protein kinase, putative	0.008	0.0098	0.4487
Echinococcus granulosus	tyrosine protein kinase Fyn	0.0106	0.0144	0.0144
Brugia malayi	AMP-binding enzyme family protein	0.0025	0.0004	0.0013
Loa Loa (eye worm)	hypothetical protein	0.0025	0.0004	0.0014
Loa Loa (eye worm)	hypothetical protein	0.1504	0.2547	1
Onchocerca volvulus		0.0201	0.0307	0.1204
Echinococcus granulosus	Immunoglobulin	0.0044	0.0037	0.0037
Schistosoma mansoni	tyrosine kinase	0.0023	0.0001	0.0001
Loa Loa (eye worm)	LBP/BPI/CETP family domain-containing protein	0.1504	0.2547	1
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0023	0.0001	0.0001
Schistosoma mansoni	microtubule-associated protein tau	0.584	1	1
Onchocerca volvulus		0.1504	0.2547	1
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0023	0.0001	0.0001
Mycobacterium ulcerans	hypothetical protein	0.0264	0.0415	1
Loa Loa (eye worm)	LBP/BPI/CETP family domain-containing protein	0.0862	0.1443	0.5667
Schistosoma mansoni	cell adhesion molecule	0.0023	0.0001	0.0001
Brugia malayi	Iron-sulfur cluster assembly accessory protein	0.0201	0.0307	0.1204
Loa Loa (eye worm)	hypothetical protein	0.0023	0.0001	0.0001
Schistosoma mansoni	chimerin-related rho-gtpase-activating protein	0.0023	0.0001	0.0001
Echinococcus granulosus	NCK adaptor protein	0.0027	0.0008	0.0007
Brugia malayi	MH2 domain containing protein	0.0239	0.0372	0.1458
Echinococcus multilocularis	thioredoxin glutathione reductase	0.0047	0.0042	0.0041
Echinococcus granulosus	neuroglian	0.0054	0.0054	0.0054
Loa Loa (eye worm)	LBP/BPI/CETP family domain-containing protein	0.0862	0.1443	0.5667
Schistosoma mansoni	adapter molecule crk	0.0027	0.0008	0.0008
Loa Loa (eye worm)	hypothetical protein	0.0642	0.1065	0.4179
Leishmania major	hypothetical protein, conserved	0.0264	0.0415	1
Echinococcus granulosus	tyrosine protein kinase Src42A	0.0106	0.0144	0.0144
Brugia malayi	hypothetical protein	0.0986	0.1656	0.6504
Brugia malayi	Tyrosine-protein kinase abl-1	0.0036	0.0023	0.009
Loa Loa (eye worm)	hypothetical protein	0.0642	0.1065	0.4179
Schistosoma mansoni	cell adhesion molecule	0.0023	0.0001	0.0001
Mycobacterium ulcerans	esterase/lipase LipP	0.0264	0.0415	1
Loa Loa (eye worm)	TK/KIN16 protein kinase	0.0483	0.0791	0.3105
Schistosoma mansoni	nephrin	0.0023	0.0001	0.0001
Echinococcus granulosus	roundabout 2	0.0067	0.0076	0.0076
Echinococcus multilocularis	tyrosine protein kinase Srms	0.0093	0.0122	0.0121
Onchocerca volvulus	Basement membrane proteoglycan homolog	0.0028	0.0009	0.0034
Echinococcus multilocularis	survival motor neuron protein 1	0.0986	0.1656	0.1656
Onchocerca volvulus		0.0264	0.0415	0.1626
Schistosoma mansoni	family S12 unassigned peptidase (S12 family)	0.0264	0.0415	0.0415
Mycobacterium ulcerans	beta-lactamase	0.0264	0.0415	1
Plasmodium vivax	hypothetical protein, conserved	0.0264	0.0415	1
Mycobacterium tuberculosis	Probable oxidoreductase	0.0118	0.0165	0.0564
Brugia malayi	AMP-binding enzyme family protein	0.0025	0.0004	0.0013
Mycobacterium tuberculosis	Probable reductase	0.0106	0.0144	0.0492
Brugia malayi	Immunoglobulin I-set domain containing protein	0.0023	0.0001	0.0001
Entamoeba histolytica	acyl-CoA synthetase, putative	0.0025	0.0004	0.0156
Onchocerca volvulus		0.1504	0.2547	1

Activities

Activity type	Activity value	Assay description	Source	Reference
EC50 (binding)	= 0.05 uM	Inhibition of BRAF (unknown origin)-mediated ERK phosphorylation by cell-based assay	ChEMBL.	25221654
IC50 (binding)	< 0.0004 uM	Inhibition of BRAF V600E mutant (unknown origin)	ChEMBL.	25221654

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?

In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.

In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

ChEMBL: CHEMBL3335373

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 931162