TDR Targets

Basic information

Technical information

TDR Targets ID: 1505545
Name: (2S)-3-[4-(dimethylcarbamoyloxy)phenyl]-2-[[2 -(ethyl-methylamino)-5-(2-methylphenyl)pyrimi din-4-yl]amino]propanoic acid
MW: 477.555 | Formula: C26H31N5O4
H donors: 2 H acceptors: 5 LogP: 4.68 Rotable bonds: 11
Rule of 5 violations (Lipinski): 1
SMILES: CCN(c1ncc(c(n1)N[C@H](C(=O)O)Cc1ccc(cc1)OC(=O)N(C)C)c1ccccc1C)C
InChi: 1S/C26H31N5O4/c1-6-31(5)25-27-16-21(20-10-8-7-9-17(20)2)23(29-25)28-22(24(32)33)15-18-11-13-19(14-12-18)35-26(34)30(3)4/h7-14,16,22H,6,15H2,1-5H3,(H,32,33)(H,27,28,29)/t22-/m0/s1
InChiKey: XHZIKHVYHSVYCX-QFIPXVFZSA-N

Network

Hover on a compound node to display the structore

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

This is a work in progress. Come back soon to try this features!

Clustering layers

This is a work in progress. Come back soon to try this features!

Synonyms

(2S)-3-[4-(dimethylcarbamoyloxy)phenyl]-2-[[2-(ethyl-methyl-amino)-5-(2-methylphenyl)pyrimidin-4-yl]amino]propanoic acid
(2S)-3-[4-(dimethylamino-oxomethoxy)phenyl]-2-[[2-(ethyl-methylamino)-5-(2-methylphenyl)-4-pyrimidinyl]amino]propanoic acid
(2S)-3-[4-(dimethylcarbamoyloxy)phenyl]-2-[[2-(ethyl-methyl-amino)-5-(2-methylphenyl)pyrimidin-4-yl]amino]propionic acid

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	integrin, beta 1 (fibronectin receptor, beta polypeptide, antigen CD29 includes MDF2, MSK12)	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Brugia malayi	Integrin beta pat-3 precursor	Get druggable targets OG5_127959	All targets in OG5_127959
Schistosoma mansoni	integrin beta subunit	Get druggable targets OG5_127959	All targets in OG5_127959
Schistosoma japonicum	Integrin beta-PS precursor, putative	Get druggable targets OG5_127959	All targets in OG5_127959
Schistosoma japonicum	Integrin beta-3 precursor, putative	Get druggable targets OG5_127959	All targets in OG5_127959
Echinococcus granulosus	integrin beta 2	Get druggable targets OG5_127959	All targets in OG5_127959
Echinococcus multilocularis	integrin beta 2	Get druggable targets OG5_127959	All targets in OG5_127959
Schistosoma japonicum	ko:K06464 integrin beta 2, putative	Get druggable targets OG5_127959	All targets in OG5_127959
Loa Loa (eye worm)	integrin beta-2	Get druggable targets OG5_127959	All targets in OG5_127959

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
Loa Loa (eye worm)	integrin beta-2	0.0378	0.0628	0.0625
Schistosoma mansoni	alpha-glucosidase	0.0136	0.0179	0.0179
Loa Loa (eye worm)	transcription factor SMAD2	0.013	0.0167	0.0164
Schistosoma mansoni	alpha-glucosidase	0.0136	0.0179	0.0179
Echinococcus multilocularis	protein dispatched 1	0.0047	0.0013	0.0011
Trichomonas vaginalis	low molecular weight protein tyrosine phosphatase, putative	0.1857	0.3366	1
Schistosoma mansoni	pcd6 interacting protein-related	0.0234	0.0361	0.0361
Mycobacterium tuberculosis	Probable epoxide hydrolase EphA (epoxide hydratase) (arene-oxide hydratase)	0.0513	0.0877	0.3758
Echinococcus multilocularis	gpi ethanolamine phosphate transferase 1	0.006	0.0039	0.0036
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.0234	0.0361	0.0359
Echinococcus granulosus	diuretic hormone 44 receptor GPRdih2	0.0063	0.0044	0.0042
Echinococcus granulosus	lysosomal alpha glucosidase	0.0158	0.022	0.0218
Loa Loa (eye worm)	hypothetical protein	0.0408	0.0684	0.0681
Brugia malayi	MH2 domain containing protein	0.013	0.0167	0.0164
Loa Loa (eye worm)	hypothetical protein	0.0383	0.0637	0.0634
Leishmania major	protein-tyrosine phosphatase 1-like protein	0.0234	0.0361	0.269
Loa Loa (eye worm)	hypothetical protein	0.0234	0.0361	0.0359
Entamoeba histolytica	hypothetical protein	0.011	0.0132	0.0356
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.0234	0.0361	0.0359
Loa Loa (eye worm)	kelch domain-containing protein family protein	0.0057	0.0034	0.0031
Onchocerca volvulus	Ectonucleotide pyrophosphatase\/phosphodiesterase family member 7 homolog	0.006	0.0039	0.0079
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0234	0.0361	0.0359
Loa Loa (eye worm)	hypothetical protein	0.0234	0.0361	0.0359
Echinococcus granulosus	ectonucleotide	0.0323	0.0525	0.0522
Echinococcus multilocularis	transferase	0.006	0.0039	0.0036
Loa Loa (eye worm)	protein tyrosine phosphatase	0.0234	0.0361	0.0359
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0234	0.0361	0.0359
Mycobacterium ulcerans	phosphotyrosine protein phosphatase PtpA	0.1857	0.3366	1
Trichomonas vaginalis	low molecular weight protein tyrosine phosphatase, putative	0.0572	0.0987	0.2927
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.0383	0.0637	0.0634
Schistosoma mansoni	ectonucleotide pyrophosphatase/phosphodiesterase	0.006	0.0039	0.0039
Loa Loa (eye worm)	hypothetical protein	0.006	0.0039	0.0036
Echinococcus multilocularis	ectonucleotide	0.0323	0.0525	0.0522
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.0234	0.0361	0.0359
Echinococcus multilocularis	tyrosine protein phosphatase non receptor type	0.0234	0.0361	0.0359
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0234	0.0361	0.0359
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0234	0.0361	0.0359
Loa Loa (eye worm)	dual specificity protein phosphatase CDC14B	0.0234	0.0361	0.0359
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0234	0.0361	0.0359
Echinococcus granulosus	Receptor type tyrosine protein phosphatase O	0.0234	0.0361	0.0359
Loa Loa (eye worm)	hypothetical protein	0.005	0.002	0.0017
Brugia malayi	hypothetical protein	0.0234	0.0361	0.0359
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0234	0.0361	0.0359
Schistosoma mansoni	transcription factor LCR-F1	0.011	0.0132	0.0132
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.0234	0.0361	0.0359
Echinococcus multilocularis	atpase aaa+ type core atpase aaa type core	0.1569	0.2833	0.2831
Loa Loa (eye worm)	hypothetical protein	0.0095	0.0103	0.0101
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.0234	0.0361	0.0359
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.0234	0.0361	0.0359
Loa Loa (eye worm)	hypothetical protein	0.006	0.0039	0.0036
Trichomonas vaginalis	low molecular weight protein-tyrosine-phosphatase, putative	0.1857	0.3366	1
Echinococcus granulosus	gpi ethanolamine phosphate transferase 3	0.006	0.0039	0.0036
Echinococcus granulosus	ectonucleotide pyrophosphatase:phosphodiesterase	0.0383	0.0637	0.0634
Trichomonas vaginalis	low molecular weight protein tyrosine phosphatase, putative	0.1857	0.3366	1
Schistosoma mansoni	receptor tyrosine phosphatase type r2a	0.0246	0.0382	0.0382
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0234	0.0361	0.0359
Brugia malayi	Protein-tyrosine phosphatase	0.0234	0.0361	0.0359
Echinococcus granulosus	Niemann Pick C1 protein	0.0136	0.0179	0.0176
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.0246	0.0382	0.0379
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.02	0.0298	0.0295
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.011	0.0132	0.0129
Loa Loa (eye worm)	hypothetical protein	0.006	0.0039	0.0036
Schistosoma mansoni	niemann-pick C1 (NPC1)	0.0097	0.0106	0.0106
Echinococcus multilocularis	receptor type tyrosine protein phosphatase H	0.0234	0.0361	0.0359
Echinococcus granulosus	ectonucleotide pyrophosphatase:phosphodiesterase	0.006	0.0039	0.0036
Loa Loa (eye worm)	hypothetical protein	0.0323	0.0525	0.0522
Loa Loa (eye worm)	hypothetical protein	0.0234	0.0361	0.0359
Onchocerca volvulus		0.0234	0.0361	0.1041
Echinococcus multilocularis		0.0234	0.0361	0.0359
Echinococcus granulosus	ectonucleotide pyrophosphatase:phosphodiesterase	0.0383	0.0637	0.0634
Loa Loa (eye worm)	hypothetical protein	0.02	0.0298	0.0295
Loa Loa (eye worm)	hypothetical protein	0.0234	0.0361	0.0359
Schistosoma mansoni	hypothetical protein	0.0063	0.0044	0.0044
Mycobacterium tuberculosis	Probable oxidoreductase	0.1289	0.2314	1
Onchocerca volvulus		0.0234	0.0361	0.1041
Loa Loa (eye worm)	hypothetical protein	0.0174	0.0249	0.0247
Schistosoma mansoni	ectonucleotide pyrophosphatase/phosphodiesterase	0.0383	0.0637	0.0637
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.0383	0.0637	0.0634
Schistosoma mansoni	rgs-gaip interacting protein gipc	0.0234	0.0361	0.0361
Onchocerca volvulus		0.0234	0.0361	0.1041
Schistosoma mansoni	hypothetical protein	0.0827	0.1459	0.1459
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0234	0.0361	0.0359
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.0234	0.0361	0.0359
Brugia malayi	Type I phosphodiesterase / nucleotide pyrophosphatase family protein	0.006	0.0039	0.0036
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.0234	0.0361	0.0359
Trypanosoma brucei	endonuclease G, putative	0.023	0.0353	0.2476
Loa Loa (eye worm)	hypothetical protein	0.0234	0.0361	0.0359
Entamoeba histolytica	protein tyrosine phosphatase, putative	0.0234	0.0361	0.1041
Echinococcus multilocularis	cadherin EGF LAG seven pass G type receptor	0.0063	0.0044	0.0042
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.0323	0.0525	0.0522
Loa Loa (eye worm)	hypothetical protein	0.0234	0.0361	0.0359
Brugia malayi	Thrombospondin type 1 domain containing protein	0.0827	0.1459	0.1456
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0234	0.0361	0.0359
Leishmania major	endonuclease G, putative	0.023	0.0353	0.263
Brugia malayi	hypothetical protein	0.0234	0.0361	0.0359
Schistosoma mansoni	receptor tyrosine phosphatase type r2a	0.0246	0.0382	0.0382
Echinococcus multilocularis	Receptor type tyrosine protein phosphatase O	0.0234	0.0361	0.0359
Echinococcus granulosus	ectonucleotide pyrophosphatase:phosphodiesterase	0.0383	0.0637	0.0634
Schistosoma mansoni	protein tyrosine phosphatase	0.0246	0.0382	0.0382
Leishmania major	DNA/RNA non-specific endonuclease-like protein	0.023	0.0353	0.263
Onchocerca volvulus		0.0234	0.0361	0.1041
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0234	0.0361	0.0359
Trypanosoma brucei	protein tyrosine phosphatase 1	0.0234	0.0361	0.2537
Echinococcus multilocularis	hypothetical protein	0.0234	0.0361	0.0359
Echinococcus granulosus	sterol O acyltransferase 1	0.0231	0.0355	0.0352
Loa Loa (eye worm)	hypothetical protein	0.0046	0.0012	0.0009
Schistosoma mansoni	protein-tyrosine phosphatase non-receptor type nt5	0.0234	0.0361	0.0361
Brugia malayi	Type I phosphodiesterase / nucleotide pyrophosphatase family protein	0.0383	0.0637	0.0634
Onchocerca volvulus		0.0827	0.1459	0.4313
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0234	0.0361	0.0359
Onchocerca volvulus		0.0234	0.0361	0.1041
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.006	0.0039	0.0036
Echinococcus multilocularis	Receptor type tyrosine protein phosphatase O	0.0234	0.0361	0.0359
Brugia malayi	Dual specificity protein phosphatase CDC14B	0.0234	0.0361	0.0359
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0234	0.0361	0.0359
Loa Loa (eye worm)	hypothetical protein	0.0383	0.0637	0.0634
Brugia malayi	Protein-tyrosine phosphatase 1	0.0234	0.0361	0.0359
Brugia malayi	Niemann-Pick C1 protein precursor	0.0095	0.0103	0.0101
Echinococcus granulosus	receptor type tyrosine protein phosphatase zeta	0.0234	0.0361	0.0359
Brugia malayi	hypothetical protein	0.006	0.0039	0.0036
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0234	0.0361	0.0359
Entamoeba histolytica	hypothetical protein	0.011	0.0132	0.0356
Schistosoma mansoni	receptor protein tyrosine phosphatase	0.0246	0.0382	0.0382
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0234	0.0361	0.0359
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0234	0.0361	0.0359
Brugia malayi	hypothetical protein	0.0234	0.0361	0.0359
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0234	0.0361	0.0359
Giardia lamblia	Protein tyrosine phosphatase	0.0234	0.0361	0.0969
Loa Loa (eye worm)	hypothetical protein	0.0234	0.0361	0.0359
Mycobacterium tuberculosis	Phosphotyrosine protein phosphatase PtpA (protein-tyrosine-phosphatase) (PTPase) (LMW phosphatase)	0.1285	0.2306	0.9967
Trichomonas vaginalis	low molecular weight protein tyrosine phosphatase, putative	0.1857	0.3366	1
Loa Loa (eye worm)	hypothetical protein	0.0234	0.0361	0.0359
Loa Loa (eye worm)	hypothetical protein	0.0231	0.0355	0.0352
Loa Loa (eye worm)	hypothetical protein	0.0208	0.0313	0.031
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0234	0.0361	0.0359
Onchocerca volvulus		0.0234	0.0361	0.1041
Echinococcus multilocularis	GPCR, family 2	0.0063	0.0044	0.0042
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0234	0.0361	0.0359
Brugia malayi	endonuclease G, mitochondrial precursor	0.023	0.0353	0.0351
Loa Loa (eye worm)	MH2 domain-containing protein	0.013	0.0167	0.0164
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0234	0.0361	0.0359
Loa Loa (eye worm)	hypothetical protein	0.0234	0.0361	0.0359
Onchocerca volvulus		0.0234	0.0361	0.1041
Schistosoma mansoni	hypothetical protein	0.0184	0.0268	0.0268
Trypanosoma cruzi	C-8 sterol isomerase, putative	0.0747	0.131	1
Schistosoma mansoni	patched 1	0.0041	0.0003	0.0003
Loa Loa (eye worm)	hypothetical protein	0.0383	0.0637	0.0634
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.0234	0.0361	0.0359
Onchocerca volvulus		0.0383	0.0637	0.1862
Loa Loa (eye worm)	phosphotyrosine protein phosphatase	0.1857	0.3366	0.3365
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0234	0.0361	0.0359
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.0234	0.0361	0.0359
Echinococcus multilocularis	receptor type tyrosine protein phosphatase F	0.0246	0.0382	0.0379
Onchocerca volvulus		0.0234	0.0361	0.1041
Echinococcus multilocularis	receptor type tyrosine protein phosphatase protein tyrosine phosphatase receptor type	0.0234	0.0361	0.0359
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0234	0.0361	0.0359
Schistosoma mansoni	protein tyrosine phosphatase	0.0234	0.0361	0.0361
Leishmania major	hypothetical protein, conserved	0.0572	0.0987	0.7516
Onchocerca volvulus		0.0234	0.0361	0.1041
Echinococcus granulosus	expressed conserved protein	0.0089	0.0093	0.009
Onchocerca volvulus	GPI ethanolamine phosphate transferase 2 homolog	0.006	0.0039	0.0079
Trichomonas vaginalis	low molecular weight protein-tyrosine-phosphatase, putative	0.1857	0.3366	1
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.0383	0.0637	0.0634
Loa Loa (eye worm)	hypothetical protein	0.0234	0.0361	0.0359
Entamoeba histolytica	protein tyrosine phosphatase, putative	0.0234	0.0361	0.1041
Echinococcus multilocularis	gpi ethanolamine phosphate transferase 3	0.006	0.0039	0.0036
Loa Loa (eye worm)	hypothetical protein	0.0174	0.0249	0.0247
Echinococcus multilocularis	lysosomal alpha glucosidase	0.0158	0.022	0.0218
Schistosoma mansoni	hypothetical protein	0.0137	0.018	0.018
Brugia malayi	hypothetical protein	0.006	0.0039	0.0036
Echinococcus multilocularis	sterol O acyltransferase 1	0.0231	0.0355	0.0352
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0234	0.0361	0.0359
Schistosoma mansoni	hypothetical protein	0.011	0.0132	0.0132
Loa Loa (eye worm)	hypothetical protein	0.0234	0.0361	0.0359
Schistosoma mansoni	protein-tyrosine phosphatase n9	0.0234	0.0361	0.0361
Onchocerca volvulus		0.0234	0.0361	0.1041
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0234	0.0361	0.0359
Loa Loa (eye worm)	type I phosphodiesterase/nucleotide pyrophosphatase	0.006	0.0039	0.0036
Echinococcus multilocularis	tyrosine protein phosphatase non receptor type	0.0234	0.0361	0.0359
Giardia lamblia	Low molecular weight protein-tyrosine-phosphatase	0.1857	0.3366	1
Loa Loa (eye worm)	latrophilin receptor protein 2	0.0063	0.0044	0.0042
Onchocerca volvulus	Ectonucleotide pyrophosphatase\/phosphodiesterase family member 6 homolog	0.006	0.0039	0.0079
Schistosoma mansoni	receptor protein tyrosine phosphatase n (ia2)	0.0234	0.0361	0.0361
Schistosoma mansoni	sterol O-acyltransferase 1	0.0231	0.0355	0.0355
Schistosoma mansoni	non-receptor protein-tyrosine phosphatase	0.0234	0.0361	0.0361
Brugia malayi	Low molecular weight phosphotyrosine protein phosphatase containing protein	0.1857	0.3366	0.3365
Schistosoma mansoni	receptor tyrosine phosphatase type r2a	0.0246	0.0382	0.0382
Loa Loa (eye worm)	hypothetical protein	0.006	0.0039	0.0036
Echinococcus multilocularis	Alkaline phosphatase, core domain	0.006	0.0039	0.0036
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0234	0.0361	0.0359
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.02	0.0298	0.0295
Onchocerca volvulus		0.0234	0.0361	0.1041
Loa Loa (eye worm)	hypothetical protein	0.0174	0.0249	0.0247
Trypanosoma cruzi	hypothetical protein, conserved	0.0572	0.0987	0.6629
Echinococcus granulosus	Receptor type tyrosine protein phosphatase O	0.0234	0.0361	0.0359
Echinococcus multilocularis	tyrosine protein phosphatase non receptor type	0.0234	0.0361	0.0359
Echinococcus multilocularis	receptor type tyrosine protein phosphatase zeta	0.0234	0.0361	0.0359
Loa Loa (eye worm)	hypothetical protein	0.0234	0.0361	0.0359
Loa Loa (eye worm)	hypothetical protein	0.0234	0.0361	0.0359
Entamoeba histolytica	hypothetical protein	0.011	0.0132	0.0356
Loa Loa (eye worm)	hypothetical protein	0.0234	0.0361	0.0359
Trypanosoma cruzi	hypothetical protein, conserved	0.0572	0.0987	0.6629
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0234	0.0361	0.0359
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0234	0.0361	0.0359
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.006	0.0039	0.0036
Onchocerca volvulus		0.0234	0.0361	0.1041
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0234	0.0361	0.0359
Plasmodium falciparum	GPI ethanolamine phosphate transferase 3, putative	0.006	0.0039	0.5
Loa Loa (eye worm)	hypothetical protein	0.0234	0.0361	0.0359
Onchocerca volvulus		0.0383	0.0637	0.1862
Echinococcus granulosus	ectonucleotide pyrophosphatase:phosphodiesterase	0.0323	0.0525	0.0522
Loa Loa (eye worm)	protein-tyrosine phosphatase 1	0.0234	0.0361	0.0359
Onchocerca volvulus		0.0234	0.0361	0.1041
Schistosoma mansoni	hypothetical protein	0.006	0.0039	0.0039
Loa Loa (eye worm)	hypothetical protein	0.0046	0.0012	0.0009
Loa Loa (eye worm)	hypothetical protein	0.0234	0.0361	0.0359
Loa Loa (eye worm)	hypothetical protein	0.0234	0.0361	0.0359
Echinococcus granulosus	Endonuclease G	0.023	0.0353	0.0351
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0234	0.0361	0.0359
Leishmania major	ethanolamine phosphotransferase, putative	0.006	0.0039	0.0205
Schistosoma mansoni	integrin beta subunit	0.0223	0.034	0.034
Onchocerca volvulus		0.0234	0.0361	0.1041
Schistosoma mansoni	ectonucleotide pyrophosphatase/phosphodiesterase	0.0383	0.0637	0.0637
Echinococcus multilocularis	diuretic hormone 44 receptor GPRdih2	0.0063	0.0044	0.0042
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.0234	0.0361	0.0359
Onchocerca volvulus	GPI ethanolamine phosphate transferase 1 homolog	0.006	0.0039	0.0079
Brugia malayi	protein-tyrosine phosphatase Lar-like precursor, putative	0.0234	0.0361	0.0359
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.0383	0.0637	0.0634
Echinococcus multilocularis	receptor type tyrosine protein phosphatase protein tyrosine phosphatase receptor type	0.0246	0.0382	0.0379
Echinococcus granulosus	cadherin EGF LAG seven pass G type receptor	0.0063	0.0044	0.0042
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.0246	0.0382	0.0379
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.0234	0.0361	0.0359
Entamoeba histolytica	Niemann-Pick C1 protein, putative	0.0095	0.0103	0.0272
Echinococcus granulosus	Niemann Pick C1 protein	0.0095	0.0103	0.0101
Brugia malayi	ERG2 and Sigma1 receptor like protein	0.0747	0.131	0.1307
Onchocerca volvulus		0.0234	0.0361	0.1041
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.0246	0.0382	0.0379
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.0246	0.0382	0.0379
Loa Loa (eye worm)	hypothetical protein	0.0234	0.0361	0.0359
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.0383	0.0637	0.0634
Trypanosoma cruzi	tyrosine specific protein phosphatase, putative	0.0234	0.0361	0.0082
Onchocerca volvulus		0.0234	0.0361	0.1041
Brugia malayi	Latrophilin receptor protein 2	0.0063	0.0044	0.0042
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.0246	0.0382	0.0379
Loa Loa (eye worm)	hypothetical protein	0.0057	0.0034	0.0031
Echinococcus granulosus	receptor type tyrosine protein phosphatase zeta	0.0246	0.0382	0.0379
Loa Loa (eye worm)	hypothetical protein	0.0137	0.018	0.0178
Echinococcus multilocularis	protein tyrosine phosphatase n9	0.0234	0.0361	0.0359
Loa Loa (eye worm)	glycosyl hydrolase family 31 protein	0.0158	0.022	0.0218
Onchocerca volvulus		0.1857	0.3366	1
Mycobacterium leprae	hypothetical protein	0.006	0.0039	1
Brugia malayi	Protein-tyrosine phosphatase	0.042	0.0704	0.0702
Echinococcus granulosus	ectonucleotide pyrophosphatase:phosphodiesterase	0.0383	0.0637	0.0634
Echinococcus granulosus	transferase	0.006	0.0039	0.0036
Schistosoma mansoni	endonuclease related	0.023	0.0353	0.0353
Echinococcus multilocularis	geminin	0.0184	0.0268	0.0265
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.0234	0.0361	0.0359
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0234	0.0361	0.0359
Loa Loa (eye worm)	protein-tyrosine-phosphatase	0.0234	0.0361	0.0359
Schistosoma mansoni	receptor protein tyrosine phosphatase r (pcptp1)	0.0234	0.0361	0.0361
Onchocerca volvulus		0.0234	0.0361	0.1041
Echinococcus multilocularis	receptor type tyrosine protein phosphatase zeta	0.0246	0.0382	0.0379
Brugia malayi	AEL166Cp	0.006	0.0039	0.0036
Toxoplasma gondii	DNA/RNA non-specific endonuclease	0.023	0.0353	0.5
Echinococcus granulosus	geminin	0.0184	0.0268	0.0265
Onchocerca volvulus		0.0234	0.0361	0.1041
Entamoeba histolytica	phosphatidylinositol-glycan biosynthesis class O protein, putative	0.006	0.0039	0.0079
Schistosoma mansoni	hypothetical protein	0.0063	0.0044	0.0044
Onchocerca volvulus		0.0234	0.0361	0.1041
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.0234	0.0361	0.0359
Echinococcus granulosus	protein tyrosine phosphatase n9	0.0234	0.0361	0.0359
Onchocerca volvulus		0.0092	0.0097	0.0252
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0234	0.0361	0.0359
Brugia malayi	hypothetical protein	0.0234	0.0361	0.0359
Schistosoma mansoni	receptor protein tyrosine phosphatase n (ia2)	0.0234	0.0361	0.0361
Echinococcus multilocularis	expressed conserved protein	0.0089	0.0093	0.009
Echinococcus multilocularis	integrin beta 2	0.028	0.0446	0.0443
Onchocerca volvulus		0.0234	0.0361	0.1041
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0234	0.0361	0.0359
Loa Loa (eye worm)	fibronectin type III domain-containing protein	0.0246	0.0382	0.0379
Trichomonas vaginalis	low molecular weight protein tyrosine phosphatase, putative	0.0572	0.0987	0.2927
Trypanosoma brucei	endonuclease G, putative	0.023	0.0353	0.2476
Brugia malayi	latrophilin 2 splice variant baaae	0.0137	0.018	0.0178
Entamoeba histolytica	hypothetical protein	0.011	0.0132	0.0356
Leishmania major	C-8 sterol isomerase-like protein	0.0747	0.131	1
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.011	0.0132	0.0129
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0234	0.0361	0.0359
Echinococcus multilocularis	Endonuclease G	0.023	0.0353	0.0351
Loa Loa (eye worm)	hypothetical protein	0.0234	0.0361	0.0359
Mycobacterium ulcerans	short chain dehydrogenase	0.1289	0.2314	0.6862
Echinococcus multilocularis	Receptor type tyrosine protein phosphatase O	0.0246	0.0382	0.0379
Loa Loa (eye worm)	hypothetical protein	0.0234	0.0361	0.0359
Trichomonas vaginalis	pten, drome, putative	0.0234	0.0361	0.1066
Echinococcus multilocularis	Receptor type tyrosine protein phosphatase O	0.0234	0.0361	0.0359
Schistosoma mansoni	protein tyrosine phosphatase n11 (shp2)	0.0234	0.0361	0.0361
Loa Loa (eye worm)	hypothetical protein	0.0046	0.0012	0.0009
Entamoeba histolytica	phosphatidylinositol-glycan biosynthesis class O protein, putative	0.006	0.0039	0.0079
Schistosoma mansoni	receptor tyrosine phosphatase type r2a	0.0246	0.0382	0.0382
Entamoeba histolytica	Pten 3-phosphoinositide phosphatase, putative	0.0234	0.0361	0.1041
Brugia malayi	hypothetical protein	0.0234	0.0361	0.0359
Brugia malayi	Glycosyl hydrolases family 31 protein	0.0158	0.022	0.0218
Trypanosoma cruzi	tyrosine specific protein phosphatase, putative	0.0234	0.0361	0.0082
Loa Loa (eye worm)	hypothetical protein	0.0234	0.0361	0.0359
Schistosoma mansoni	hypothetical protein	0.0184	0.0268	0.0268
Echinococcus granulosus	ectonucleotide pyrophosphatase:phosphodiesterase	0.0383	0.0637	0.0634
Schistosoma mansoni	hypothetical protein	0.0063	0.0044	0.0044
Onchocerca volvulus		0.0185	0.027	0.0769
Echinococcus multilocularis	tyrosine protein phosphatase non receptor type	0.0234	0.0361	0.0359
Trypanosoma brucei	low molecular weight protein tyrosine phosphatase, putative	0.0572	0.0987	0.7464
Echinococcus multilocularis	ectonucleotide pyrophosphatase:phosphodiesterase	0.0383	0.0637	0.0634
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0234	0.0361	0.0359
Echinococcus multilocularis	lysosomal alpha glucosidase	0.0158	0.022	0.0218
Schistosoma mansoni	ectonucleotide pyrophosphatase/phosphodiesterase	0.0383	0.0637	0.0637
Loa Loa (eye worm)	hypothetical protein	0.0382	0.0634	0.0631
Brugia malayi	AMP-binding enzyme family protein	0.0046	0.0012	0.0009
Onchocerca volvulus	GPI ethanolamine phosphate transferase 3 homolog	0.006	0.0039	0.0079
Onchocerca volvulus		0.0234	0.0361	0.1041
Loa Loa (eye worm)	hypothetical protein	0.0234	0.0361	0.0359
Echinococcus multilocularis	Niemann Pick C1 protein	0.0136	0.0179	0.0176
Mycobacterium ulcerans	epoxide hydrolase EphA	0.0513	0.0877	0.2579
Brugia malayi	Kelch motif family protein	0.0057	0.0034	0.0031
Trichomonas vaginalis	low molecular weight protein-tyrosine-phosphatase, putative	0.1857	0.3366	1
Leishmania major	tyrosine specific protein phosphatase, putative	0.0234	0.0361	0.269
Brugia malayi	calcium-independent alpha-latrotoxin receptor 2, putative	0.0063	0.0044	0.0042
Trypanosoma cruzi	tyrosine specific protein phosphatase, putative	0.0234	0.0361	0.0082
Entamoeba histolytica	protein tyrosine phosphatase, putative	0.1857	0.3366	1
Onchocerca volvulus		0.0234	0.0361	0.1041
Brugia malayi	hypothetical protein	0.0057	0.0034	0.0031
Mycobacterium ulcerans	hypothetical protein	0.006	0.0039	0.0079
Onchocerca volvulus		0.0234	0.0361	0.1041
Entamoeba histolytica	protein tyrosine phosphatase, putative	0.1857	0.3366	1
Schistosoma mansoni	ectonucleotide pyrophosphatase/phosphodiesterase	0.0383	0.0637	0.0637
Schistosoma mansoni	hypothetical protein	0.006	0.0039	0.0039
Echinococcus granulosus	GPCR family 2	0.0063	0.0044	0.0042
Schistosoma mansoni	hypothetical protein	0.0063	0.0044	0.0044
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0234	0.0361	0.0359
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0234	0.0361	0.0359
Schistosoma mansoni	hypothetical protein	0.006	0.0039	0.0039
Brugia malayi	Calcitonin receptor-like protein seb-1	0.02	0.0298	0.0295
Brugia malayi	AMP-binding enzyme family protein	0.0046	0.0012	0.0009
Loa Loa (eye worm)	hypothetical protein	0.0063	0.0044	0.0042
Schistosoma mansoni	hypothetical protein	0.006	0.0039	0.0039
Echinococcus granulosus	integrin beta 2	0.028	0.0446	0.0443
Schistosoma mansoni	protein tyrosine phosphatase	0.0234	0.0361	0.0361
Loa Loa (eye worm)	hypothetical protein	0.0747	0.131	0.1307
Brugia malayi	hypothetical protein	0.011	0.0132	0.0129
Loa Loa (eye worm)	hypothetical protein	0.0234	0.0361	0.0359
Loa Loa (eye worm)	hypothetical protein	0.0234	0.0361	0.0359
Schistosoma mansoni	receptor tyrosine phosphatase type r2a	0.0234	0.0361	0.0361
Trypanosoma brucei	C-8 sterol isomerase, putative	0.0747	0.131	1
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0234	0.0361	0.0359
Onchocerca volvulus	4.1 G protein, putative homolog	0.0234	0.0361	0.1041
Trypanosoma brucei	endonuclease G, putative	0.023	0.0353	0.2476
Brugia malayi	Integrin beta pat-3 precursor	0.0378	0.0628	0.0625
Brugia malayi	AMP-binding enzyme family protein	0.0046	0.0012	0.0009
Echinococcus multilocularis	Niemann Pick C1 protein	0.0095	0.0103	0.0101
Loa Loa (eye worm)	hypothetical protein	0.0234	0.0361	0.0359
Loa Loa (eye worm)	thrombospondin type 1 domain-containing protein	0.0827	0.1459	0.1456

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 5.3 nM	Inhibition of integrin alpha4beta1-mediated Jurkat cell adhesion to VCAM-1 by FACS analysis	ChEMBL.	21316228

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: CHEMBL1684979

Bibliographic References

1 literature reference was collected for this gene.

If you have references for this compound, please enter them in a user comment (below) or Contact us.

Detailed information for compound 1505545