TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 902.829 | Formula: C44H52BrN7O9
H donors: 8 H acceptors: 8 LogP: 4.75 Rotable bonds: 28
Rule of 5 violations (Lipinski): 3
SMILES: O=C(/C=C\c1ccc(cc1)Br)NCCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)Cc1ccccc1)CC(=O)O)NC(=O)[C@H](Cc1c[nH]c2c1cccc2)NC(=O)OC(C)(C)C
InChi: 1S/C44H52BrN7O9/c1-44(2,3)61-43(60)52-35(24-29-26-48-32-14-8-7-13-31(29)32)41(58)49-33(15-9-10-22-47-37(53)21-18-27-16-19-30(45)20-17-27)40(57)51-36(25-38(54)55)42(59)50-34(39(46)56)23-28-11-5-4-6-12-28/h4-8,11-14,16-21,26,33-36,48H,9-10,15,22-25H2,1-3H3,(H2,46,56)(H,47,53)(H,49,58)(H,50,59)(H,51,57)(H,52,60)(H,54,55)/b21-18-/t33-,34-,35-,36-/m0/s1
InChiKey: LUSDGUAJGAQFKJ-HQJAZGTDSA-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	cholecystokinin B receptor	Starlite/ChEMBL	References
Cavia porcellus	Cholecystokinin A receptor	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Brugia malayi	hypothetical protein	Get druggable targets OG5_132882	All targets in OG5_132882
Brugia malayi	sulfakinin receptor protein	Get druggable targets OG5_132882	All targets in OG5_132882
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_132882	All targets in OG5_132882

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Echinococcus multilocularis	neuropeptides capa receptor	Cholecystokinin A receptor	430 aa	414 aa	19.8 %
Echinococcus multilocularis	serotonin receptor	Cholecystokinin A receptor	430 aa	427 aa	23.7 %
Schistosoma japonicum	FMRFamide receptor, putative	Cholecystokinin A receptor	430 aa	364 aa	22.8 %
Onchocerca volvulus		Cholecystokinin A receptor	430 aa	397 aa	29.0 %
Echinococcus multilocularis	orexin receptor type 2	Cholecystokinin A receptor	430 aa	381 aa	23.6 %
Echinococcus granulosus	g protein coupled receptor	Cholecystokinin A receptor	430 aa	398 aa	23.9 %
Echinococcus granulosus	rhodopsin orphan GPCR	Cholecystokinin A receptor	430 aa	363 aa	19.6 %
Echinococcus granulosus	orexin receptor type 2	Cholecystokinin A receptor	430 aa	383 aa	23.2 %
Schistosoma mansoni	rhodopsin-like orphan GPCR	Cholecystokinin A receptor	430 aa	378 aa	23.8 %
Onchocerca volvulus	Forkhead box protein biniou homolog	Cholecystokinin A receptor	430 aa	353 aa	22.1 %
Echinococcus multilocularis	g protein coupled receptor	Cholecystokinin A receptor	430 aa	414 aa	23.4 %
Onchocerca volvulus	Phospholipase d-related homolog	Cholecystokinin A receptor	430 aa	359 aa	20.9 %
Echinococcus multilocularis	rhodopsin orphan GPCR	Cholecystokinin A receptor	430 aa	363 aa	19.3 %
Schistosoma japonicum	ko:K04145 dopamine receptor D2, putative	Cholecystokinin A receptor	430 aa	395 aa	24.8 %
Schistosoma japonicum	ko:K04207 neuropeptide Y receptor Y5, putative	Cholecystokinin A receptor	430 aa	402 aa	26.1 %
Onchocerca volvulus	Mitochondrial inner membrane protein homolog	Cholecystokinin A receptor	430 aa	363 aa	24.5 %
Schistosoma mansoni	amine GPCR	Cholecystokinin A receptor	430 aa	409 aa	24.7 %
Schistosoma mansoni	peptide (FMRFamide/neurokinin-3)-like receptor	Cholecystokinin A receptor	430 aa	381 aa	21.5 %
Onchocerca volvulus		Cholecystokinin A receptor	430 aa	377 aa	22.3 %
Echinococcus granulosus	dro:myosuppressin receptor	Cholecystokinin A receptor	430 aa	369 aa	23.0 %
Echinococcus multilocularis	dro:myosuppressin receptor	Cholecystokinin A receptor	430 aa	369 aa	23.0 %
Echinococcus granulosus	g protein coupled receptor	Cholecystokinin A receptor	430 aa	415 aa	23.1 %
Echinococcus multilocularis	g protein coupled receptor	Cholecystokinin A receptor	430 aa	405 aa	24.2 %
Schistosoma japonicum	ko:K04209 neuropeptide Y receptor, invertebrate, putative	Cholecystokinin A receptor	430 aa	356 aa	27.5 %
Schistosoma mansoni	peptide (FMRFamide/somatostatin)-like receptor	Cholecystokinin A receptor	430 aa	384 aa	21.4 %
Schistosoma mansoni	biogenic amine (5HT) receptor	Cholecystokinin A receptor	430 aa	373 aa	28.4 %
Schistosoma japonicum	ko:K04136 adrenergic receptor, alpha 1b, putative	Cholecystokinin A receptor	430 aa	375 aa	26.4 %
Echinococcus granulosus	biogenic amine 5HT receptor	Cholecystokinin A receptor	430 aa	428 aa	23.6 %
Schistosoma japonicum	IPR000276,Rhodopsin-like GPCR superfamily,domain-containing	Cholecystokinin A receptor	430 aa	382 aa	25.1 %
Schistosoma japonicum	IPR000276,Rhodopsin-like GPCR superfamily,domain-containing	Cholecystokinin A receptor	430 aa	383 aa	22.7 %
Schistosoma japonicum	ko:K04135 adrenergic receptor, alpha 1a, putative	Cholecystokinin A receptor	430 aa	373 aa	27.3 %
Onchocerca volvulus		Cholecystokinin A receptor	430 aa	410 aa	25.4 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.0083	0.0123	0.0374
Toxoplasma gondii	bifunctional dihydrofolate reductase-thymidylate synthase	0.0183	0.107	1
Mycobacterium tuberculosis	Probable thymidylate synthase ThyA (ts) (TSASE)	0.013	0.0566	0.5
Schistosoma mansoni	sodium/chloride dependent transporter	0.0415	0.3284	1
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.0083	0.0123	0.0374
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0317	0.2354	0.2503
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0083	0.0123	0.0123
Loa Loa (eye worm)	hypothetical protein	0.0083	0.0123	0.0131
Loa Loa (eye worm)	hypothetical protein	0.0083	0.0123	0.0131
Loa Loa (eye worm)	hypothetical protein	0.0973	0.861	0.9155
Schistosoma mansoni	protein-tyrosine phosphatase non-receptor type nt5	0.0083	0.0123	0.0374
Loa Loa (eye worm)	hypothetical protein	0.0083	0.0123	0.0131
Plasmodium vivax	bifunctional dihydrofolate reductase-thymidylate synthase, putative	0.0183	0.107	1
Entamoeba histolytica	protein tyrosine phosphatase, putative	0.0083	0.0123	0.5
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0083	0.0123	0.0123
Schistosoma mansoni	receptor tyrosine phosphatase type r2a	0.0146	0.0719	0.2188
Trypanosoma cruzi	dihydrofolate reductase-thymidylate synthase	0.0183	0.107	1
Echinococcus multilocularis	receptor type tyrosine protein phosphatase protein tyrosine phosphatase receptor type	0.0146	0.0719	0.2188
Onchocerca volvulus		0.0083	0.0123	0.0133
Brugia malayi	hypothetical protein	0.0083	0.0123	0.0123
Loa Loa (eye worm)	hypothetical protein	0.0973	0.861	0.9155
Brugia malayi	hypothetical protein	0.0083	0.0123	0.0123
Schistosoma mansoni	receptor tyrosine phosphatase type r2a	0.0146	0.0719	0.2188
Schistosoma mansoni	non-receptor protein-tyrosine phosphatase	0.0083	0.0123	0.0374
Onchocerca volvulus		0.0083	0.0123	0.0133
Brugia malayi	Sodium:neurotransmitter symporter family protein	0.0415	0.3284	0.3284
Echinococcus multilocularis	hypothetical protein	0.0083	0.0123	0.0374
Loa Loa (eye worm)	hypothetical protein	0.0973	0.861	0.9155
Onchocerca volvulus		0.0083	0.0123	0.0133
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0083	0.0123	0.0123
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0083	0.0123	0.0123
Loa Loa (eye worm)	hypothetical protein	0.0083	0.0123	0.0131
Onchocerca volvulus		0.0083	0.0123	0.0133
Echinococcus multilocularis	tyrosine protein phosphatase non receptor type	0.0083	0.0123	0.0374
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0083	0.0123	0.0123
Echinococcus granulosus	Receptor type tyrosine protein phosphatase O	0.0083	0.0123	0.0374
Schistosoma mansoni	norepinephrine/norepinephrine transporter	0.0415	0.3284	1
Loa Loa (eye worm)	hypothetical protein	0.0083	0.0123	0.0131
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.0083	0.0123	0.0374
Loa Loa (eye worm)	hypothetical protein	0.0083	0.0123	0.0131
Brugia malayi	hypothetical protein	0.0083	0.0123	0.0123
Onchocerca volvulus		0.0083	0.0123	0.0133
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0083	0.0123	0.0123
Brugia malayi	hypothetical protein	0.0083	0.0123	0.0123
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.0083	0.0123	0.0374
Loa Loa (eye worm)	hypothetical protein	0.0083	0.0123	0.0131
Loa Loa (eye worm)	hypothetical protein	0.0083	0.0123	0.0131
Schistosoma mansoni	protein-tyrosine phosphatase n9	0.0083	0.0123	0.0374
Loa Loa (eye worm)	dual specificity protein phosphatase CDC14B	0.0083	0.0123	0.0131
Schistosoma mansoni	receptor tyrosine phosphatase type r2a	0.0146	0.0719	0.2188
Echinococcus multilocularis	receptor type tyrosine protein phosphatase zeta	0.0146	0.0719	0.2188
Onchocerca volvulus		0.1036	0.9206	1
Loa Loa (eye worm)	hypothetical protein	0.0083	0.0123	0.0131
Echinococcus multilocularis	receptor type tyrosine protein phosphatase zeta	0.0083	0.0123	0.0374
Onchocerca volvulus		0.0083	0.0123	0.0133
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.0083	0.0123	0.0374
Echinococcus granulosus	survival motor neuron protein 1	0.0228	0.1507	0.4589
Loa Loa (eye worm)	hypothetical protein	0.0083	0.0123	0.0131
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.0146	0.0719	0.2188
Echinococcus multilocularis	survival motor neuron protein 1	0.0228	0.1507	0.4589
Loa Loa (eye worm)	hypothetical protein	0.0083	0.0123	0.0131
Echinococcus granulosus	Receptor type tyrosine protein phosphatase O	0.0083	0.0123	0.0374
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.0083	0.0123	0.0374
Onchocerca volvulus		0.0083	0.0123	0.0133
Schistosoma mansoni	protein tyrosine phosphatase n11 (shp2)	0.0083	0.0123	0.0374
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0083	0.0123	0.0123
Echinococcus granulosus	protein tyrosine phosphatase n9	0.0083	0.0123	0.0374
Schistosoma mansoni	receptor tyrosine phosphatase type r2a	0.0146	0.0719	0.2188
Loa Loa (eye worm)	solute carrier family 6 member 4	0.0415	0.3284	0.3492
Plasmodium falciparum	bifunctional dihydrofolate reductase-thymidylate synthase	0.0183	0.107	1
Mycobacterium leprae	PROBABLE THYMIDYLATE SYNTHASE THYA (TS) (TSASE)	0.013	0.0566	0.5
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0083	0.0123	0.0131
Entamoeba histolytica	protein tyrosine phosphatase, putative	0.0083	0.0123	0.5
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0083	0.0123	0.0123
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.0146	0.0719	0.2188
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.0146	0.0719	0.2188
Echinococcus multilocularis	protein tyrosine phosphatase n9	0.0083	0.0123	0.0374
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.0083	0.0123	0.0374
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0083	0.0123	0.0131
Loa Loa (eye worm)	hypothetical protein	0.1057	0.9404	1
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0083	0.0123	0.0131
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0083	0.0123	0.0131
Giardia lamblia	Protein tyrosine phosphatase	0.0083	0.0123	0.5
Onchocerca volvulus		0.0083	0.0123	0.0133
Loa Loa (eye worm)	protein-tyrosine-phosphatase	0.0083	0.0123	0.0131
Echinococcus multilocularis	tyrosine protein phosphatase non receptor type	0.0317	0.2354	0.7169
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0083	0.0123	0.0123
Onchocerca volvulus		0.0415	0.3284	0.3567
Brugia malayi	hypothetical protein	0.0228	0.1507	0.1507
Onchocerca volvulus		0.0083	0.0123	0.0133
Brugia malayi	hypothetical protein	0.0261	0.1819	0.1819
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0083	0.0123	0.0123
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0083	0.0123	0.0123
Onchocerca volvulus		0.0083	0.0123	0.0133
Brugia malayi	Dual specificity protein phosphatase CDC14B	0.0083	0.0123	0.0123
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0083	0.0123	0.0123
Loa Loa (eye worm)	hypothetical protein	0.0083	0.0123	0.0131
Loa Loa (eye worm)	hypothetical protein	0.0083	0.0123	0.0131
Echinococcus multilocularis		0.0083	0.0123	0.0374
Loa Loa (eye worm)	serotonin transporter b	0.0415	0.3284	0.3492
Echinococcus multilocularis	Receptor type tyrosine protein phosphatase O	0.0083	0.0123	0.0374
Schistosoma mansoni	bifunctional dihydrofolate reductase-thymidylate synthase	0.013	0.0566	0.1723
Loa Loa (eye worm)	fibronectin type III domain-containing protein	0.0146	0.0719	0.0764
Loa Loa (eye worm)	hypothetical protein	0.0083	0.0123	0.0131
Onchocerca volvulus		0.0083	0.0123	0.0133
Loa Loa (eye worm)	protein tyrosine phosphatase	0.0083	0.0123	0.0131
Loa Loa (eye worm)	hypothetical protein	0.0415	0.3284	0.3492
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0083	0.0123	0.0131
Schistosoma mansoni	receptor protein tyrosine phosphatase r (pcptp1)	0.0083	0.0123	0.0374
Onchocerca volvulus		0.0083	0.0123	0.0133
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0083	0.0123	0.0131
Echinococcus granulosus	serotonin transporter	0.0415	0.3284	1
Brugia malayi	thymidylate synthase	0.013	0.0566	0.0566
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0083	0.0123	0.0123
Loa Loa (eye worm)	hypothetical protein	0.0415	0.3284	0.3492
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0083	0.0123	0.0123
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0083	0.0123	0.0123
Onchocerca volvulus		0.0083	0.0123	0.0133
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0083	0.0123	0.0131
Echinococcus multilocularis	receptor type tyrosine protein phosphatase protein tyrosine phosphatase receptor type	0.0083	0.0123	0.0374
Schistosoma mansoni	receptor protein tyrosine phosphatase	0.0146	0.0719	0.2188
Loa Loa (eye worm)	hypothetical protein	0.0083	0.0123	0.0131
Loa Loa (eye worm)	hypothetical protein	0.0083	0.0123	0.0131
Onchocerca volvulus		0.0083	0.0123	0.0133
Loa Loa (eye worm)	hypothetical protein	0.0083	0.0123	0.0131
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.0146	0.0719	0.2188
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0083	0.0123	0.0131
Schistosoma mansoni	protein tyrosine phosphatase non-receptor type nt1	0.0317	0.2354	0.7169
Loa Loa (eye worm)	hypothetical protein	0.0261	0.1819	0.1934
Loa Loa (eye worm)	hypothetical protein	0.0083	0.0123	0.0131
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.0083	0.0123	0.0374
Trichomonas vaginalis	pten, drome, putative	0.0083	0.0123	0.5
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0083	0.0123	0.0123
Brugia malayi	hypothetical protein	0.0083	0.0123	0.0123
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0083	0.0123	0.0123
Echinococcus granulosus	receptor type tyrosine protein phosphatase zeta	0.0146	0.0719	0.2188
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0083	0.0123	0.0131
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.0083	0.0123	0.0374
Schistosoma mansoni	protein tyrosine phosphatase	0.0146	0.0719	0.2188
Echinococcus multilocularis	receptor type tyrosine protein phosphatase H	0.0083	0.0123	0.0374
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0083	0.0123	0.0123
Echinococcus multilocularis	serotonin transporter	0.0415	0.3284	1
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.0083	0.0123	0.0374
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0083	0.0123	0.0123
Brugia malayi	sulfakinin receptor protein	0.0261	0.1819	0.1819
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.0083	0.0123	0.0374
Loa Loa (eye worm)	hypothetical protein	0.0083	0.0123	0.0131
Echinococcus granulosus	thymidylate synthase	0.013	0.0566	0.1723
Brugia malayi	Protein-tyrosine phosphatase 1	0.0083	0.0123	0.0123
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0083	0.0123	0.0123
Mycobacterium ulcerans	thymidylate synthase	0.013	0.0566	0.5
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0083	0.0123	0.0131
Echinococcus multilocularis	tyrosine protein phosphatase non receptor type	0.0083	0.0123	0.0374
Loa Loa (eye worm)	hypothetical protein	0.0083	0.0123	0.0131
Echinococcus multilocularis	thymidylate synthase	0.013	0.0566	0.1723
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.0317	0.2354	0.7169
Onchocerca volvulus		0.0083	0.0123	0.0133
Onchocerca volvulus		0.0083	0.0123	0.0133
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0083	0.0123	0.0131
Schistosoma mansoni	pcd6 interacting protein-related	0.0083	0.0123	0.0374
Loa Loa (eye worm)	hypothetical protein	0.0228	0.1507	0.1602
Onchocerca volvulus		0.0083	0.0123	0.0133
Onchocerca volvulus	4.1 G protein, putative homolog	0.0083	0.0123	0.0133
Schistosoma mansoni	protein tyrosine phosphatase	0.0083	0.0123	0.0374
Entamoeba histolytica	Pten 3-phosphoinositide phosphatase, putative	0.0083	0.0123	0.5
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0083	0.0123	0.0123
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.0083	0.0123	0.0374
Loa Loa (eye worm)	norepinephrine transporter	0.0415	0.3284	0.3492
Echinococcus granulosus	tyrosine protein phosphatase non receptor type	0.0083	0.0123	0.0374
Echinococcus multilocularis	tyrosine protein phosphatase non receptor type	0.0083	0.0123	0.0374
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0083	0.0123	0.0131
Treponema pallidum	sodium- and chloride- dependent transporter	0.0415	0.3284	0.5
Leishmania major	dihydrofolate reductase-thymidylate synthase	0.0183	0.107	1
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0083	0.0123	0.0131
Chlamydia trachomatis	Ssodium-dependent amino acid transporter	0.007	0	0.5
Loa Loa (eye worm)	hypothetical protein	0.0083	0.0123	0.0131
Echinococcus granulosus	receptor type tyrosine protein phosphatase	0.0146	0.0719	0.2188
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0317	0.2354	0.2354
Brugia malayi	protein-tyrosine phosphatase Lar-like precursor, putative	0.0083	0.0123	0.0123
Loa Loa (eye worm)	thymidylate synthase	0.013	0.0566	0.0602
Echinococcus multilocularis	Receptor type tyrosine protein phosphatase O	0.0146	0.0719	0.2188
Brugia malayi	Protein-tyrosine phosphatase	0.0083	0.0123	0.0123
Schistosoma mansoni	receptor protein tyrosine phosphatase n (ia2)	0.0083	0.0123	0.0374
Onchocerca volvulus		0.013	0.0566	0.0615
Loa Loa (eye worm)	hypothetical protein	0.0083	0.0123	0.0131
Onchocerca volvulus		0.0083	0.0123	0.0133
Trypanosoma brucei	dihydrofolate reductase-thymidylate synthase	0.0183	0.107	1
Loa Loa (eye worm)	protein-tyrosine phosphatase	0.0083	0.0123	0.0131
Brugia malayi	Protein-tyrosine phosphatase containing protein	0.0083	0.0123	0.0123
Onchocerca volvulus		0.0083	0.0123	0.0133
Echinococcus multilocularis	receptor type tyrosine protein phosphatase	0.0083	0.0123	0.0374
Echinococcus granulosus	receptor type tyrosine protein phosphatase zeta	0.0083	0.0123	0.0374
Loa Loa (eye worm)	hypothetical protein	0.0083	0.0123	0.0131
Onchocerca volvulus		0.0083	0.0123	0.0133
Schistosoma mansoni	rgs-gaip interacting protein gipc	0.0083	0.0123	0.0374
Echinococcus multilocularis	receptor type tyrosine protein phosphatase F	0.0146	0.0719	0.2188
Onchocerca volvulus		0.0083	0.0123	0.0133
Echinococcus multilocularis	Receptor type tyrosine protein phosphatase O	0.0083	0.0123	0.0374
Echinococcus multilocularis	Receptor type tyrosine protein phosphatase O	0.0083	0.0123	0.0374
Schistosoma mansoni	receptor tyrosine phosphatase type r2a	0.0083	0.0123	0.0374
Onchocerca volvulus		0.0083	0.0123	0.0133
Schistosoma mansoni	receptor protein tyrosine phosphatase n (ia2)	0.0083	0.0123	0.0374
Loa Loa (eye worm)	protein-tyrosine phosphatase 1	0.0083	0.0123	0.0131
Loa Loa (eye worm)	hypothetical protein	0.0083	0.0123	0.0131
Schistosoma mansoni	protein tyrosine phosphatase	0.0083	0.0123	0.0374
Loa Loa (eye worm)	hypothetical protein	0.0083	0.0123	0.0131
Echinococcus multilocularis	tyrosine protein phosphatase non receptor type	0.0083	0.0123	0.0374
Onchocerca volvulus		0.0083	0.0123	0.0133
Loa Loa (eye worm)	hypothetical protein	0.0415	0.3284	0.3492

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 140 nm	Inhibition of specific binding of [125I]-BH-CCK-8 in guinea pig pancreas.	ChEMBL.	1375964
IC50 (binding)	= 5100 nm	Inhibition of specific binding of [125I]-BH-CCK-8 in guinea pig cortex	ChEMBL.	1375964

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: CHEMBL3144562

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1851254