Detailed information for compound 1736252

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 396.356 | Formula: C15H30N2O6P2
  • H donors: 4 H acceptors: 6 LogP: 1.02 Rotable bonds: 13
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCCCCCCCCn1cc[n+](c1)CC(P(=O)(O)O)P(=O)(O)[O-]
  • InChi: 1S/C15H30N2O6P2/c1-2-3-4-5-6-7-8-9-10-16-11-12-17(14-16)13-15(24(18,19)20)25(21,22)23/h11-12,14-15H,2-10,13H2,1H3,(H3-,18,19,20,21,22,23)
  • InChiKey: GYTSEUQBLYSXFG-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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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 farnesyl diphosphate synthase Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Mycobacterium ulcerans geranylgeranyl pyrophosphate synthase Get druggable targets OG5_127590 All targets in OG5_127590
Leishmania braziliensis farnesyl pyrophosphate synthase Get druggable targets OG5_127590 All targets in OG5_127590
Toxoplasma gondii polyprenyl synthetase superfamily protein Get druggable targets OG5_127590 All targets in OG5_127590
Trichomonas vaginalis geranylgeranyl pyrophosphate synthase, putative Get druggable targets OG5_127590 All targets in OG5_127590
Plasmodium berghei geranylgeranyl pyrophosphate synthase, putative Get druggable targets OG5_127590 All targets in OG5_127590
Trypanosoma congolense farnesyl pyrophosphate synthase Get druggable targets OG5_127590 All targets in OG5_127590
Leishmania infantum farnesyl pyrophosphate synthase Get druggable targets OG5_127590 All targets in OG5_127590
Trypanosoma brucei gambiense farnesyl pyrophosphate synthase, putative Get druggable targets OG5_127590 All targets in OG5_127590
Leishmania mexicana farnesyl pyrophosphate synthase, putative Get druggable targets OG5_127590 All targets in OG5_127590
Schistosoma mansoni farnesyl pyrophosphate synthase Get druggable targets OG5_127590 All targets in OG5_127590
Schistosoma japonicum ko:K00787 dimethylallyltranstransferase [EC2.5.1.1], putative Get druggable targets OG5_127590 All targets in OG5_127590
Echinococcus granulosus farnesyl pyrophosphate synthase Get druggable targets OG5_127590 All targets in OG5_127590
Trypanosoma brucei farnesyl pyrophosphate synthase Get druggable targets OG5_127590 All targets in OG5_127590
Mycobacterium ulcerans geranylgeranyl pyrophosphate synthase Get druggable targets OG5_127590 All targets in OG5_127590
Trichomonas vaginalis geranylgeranyl pyrophosphate synthase, putative Get druggable targets OG5_127590 All targets in OG5_127590
Mycobacterium tuberculosis Probable geranylgeranyl pyrophosphate synthetase IdsA2 (ggppsase) (GGPP synthetase) (geranylgeranyl diphosphate synthase) Get druggable targets OG5_127590 All targets in OG5_127590
Leishmania major farnesyl pyrophosphate synthase Get druggable targets OG5_127590 All targets in OG5_127590
Loa Loa (eye worm) polyprenyl synthetase Get druggable targets OG5_127590 All targets in OG5_127590
Giardia lamblia Farnesyl diphosphate synthase Get druggable targets OG5_127590 All targets in OG5_127590
Candida albicans similar to S. cerevisiae ERG20 (YJL167W) farnesyl diphosphate synthetase (FPP synthetase) Get druggable targets OG5_127590 All targets in OG5_127590
Cryptosporidium parvum putative farnesyl pyrophosphate synthase Get druggable targets OG5_127590 All targets in OG5_127590
Echinococcus multilocularis farnesyl pyrophosphate synthase Get druggable targets OG5_127590 All targets in OG5_127590
Brugia malayi Polyprenyl synthetase family protein Get druggable targets OG5_127590 All targets in OG5_127590
Plasmodium knowlesi geranylgeranyl pyrophosphate synthase, putative Get druggable targets OG5_127590 All targets in OG5_127590
Theileria parva farnesyl pyrophosphate synthetase, putative Get druggable targets OG5_127590 All targets in OG5_127590
Plasmodium falciparum geranylgeranyl pyrophosphate synthase, putative Get druggable targets OG5_127590 All targets in OG5_127590
Candida albicans similar to S. cerevisiae ERG20 (YJL167W) farnesyl diphosphate synthetase (FPP synthetase) Get druggable targets OG5_127590 All targets in OG5_127590
Plasmodium yoelii farnesyl pyrophosphate synthase Get druggable targets OG5_127590 All targets in OG5_127590
Trypanosoma cruzi farnesyl pyrophosphate synthase Get druggable targets OG5_127590 All targets in OG5_127590
Trichomonas vaginalis geranylgeranyl diphosphate synthase, putative Get druggable targets OG5_127590 All targets in OG5_127590
Babesia bovis farnesyl pyrophosphate synthetase, putative Get druggable targets OG5_127590 All targets in OG5_127590
Neospora caninum hypothetical protein Get druggable targets OG5_127590 All targets in OG5_127590
Leishmania donovani farnesyl pyrophosphate synthase Get druggable targets OG5_127590 All targets in OG5_127590
Plasmodium vivax geranylgeranyl pyrophosphate synthase Get druggable targets OG5_127590 All targets in OG5_127590
Cryptosporidium hominis farnesyl pyrophosphate synthase Get druggable targets OG5_127590 All targets in OG5_127590
Trypanosoma cruzi farnesyl pyrophosphate synthase, putative Get druggable targets OG5_127590 All targets in OG5_127590
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Brugia malayi Cytochrome P450 family protein 0.00149461 0.00694797 0.00694797
Trichomonas vaginalis AGC family protein kinase 0.00553735 0.0340135 0.0327525
Leishmania major protein kinase, putative 0.00553735 0.0340135 0.0340135
Loa Loa (eye worm) AUR protein kinase 0.00553735 0.0340135 0.0340135
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.000634807 0.00119175 0.00119175
Entamoeba histolytica serine/threonine protein kinase 6, putative 0.00553735 0.0340135 0.016444
Brugia malayi Cytochrome P450 family protein 0.00149461 0.00694797 0.00694797
Loa Loa (eye worm) cytochrome P450 family protein 0.00149461 0.00694797 0.00694797
Schistosoma mansoni neuroglian 0.000634807 0.00119175 0.00119175
Trichomonas vaginalis N-myristoyl transferase, putative 0.149826 1 1
Loa Loa (eye worm) hypothetical protein 0.00109188 0.00425179 0.00425179
Brugia malayi Immunoglobulin I-set domain containing protein 0.000634807 0.00119175 0.00119175
Loa Loa (eye worm) cytochrome P450 family protein 0.00149461 0.00694797 0.00694797
Schistosoma mansoni hyperpolarization activated cyclic nucleotide-gated potassium channel 0.000651517 0.00130362 0.00130362
Trichomonas vaginalis AGC family protein kinase 0.00553735 0.0340135 0.0327525
Loa Loa (eye worm) hypothetical protein 0.00109188 0.00425179 0.00425179
Trypanosoma brucei N-myristoyltransferase 0.149826 1 1
Echinococcus granulosus roundabout 2 0.000634807 0.00119175 0.00119175
Mycobacterium ulcerans geranylgeranyl pyrophosphate synthase 0.0123843 0.0798524 1
Plasmodium falciparum serine/threonine protein kinase, putative 0.00553735 0.0340135 0.0340135
Schistosoma mansoni cell adhesion molecule 0.00144784 0.0066349 0.0066349
Onchocerca volvulus Tyrosine kinase homolog 0.0165743 0.107904 1
Schistosoma mansoni cell adhesion molecule 0.000634807 0.00119175 0.00119175
Loa Loa (eye worm) hypothetical protein 0.0103627 0.0663188 0.0663188
Onchocerca volvulus 0.0161963 0.105373 0.976282
Brugia malayi Immunoglobulin I-set domain containing protein 0.000634807 0.00119175 0.00119175
Loa Loa (eye worm) AUR protein kinase 0.00553735 0.0340135 0.0340135
Trypanosoma brucei aurora B kinase 0.00553735 0.0340135 0.0272549
Toxoplasma gondii aurora kinase 0.00553735 0.0340135 0.425954
Mycobacterium ulcerans geranylgeranyl pyrophosphate synthase 0.0123843 0.0798524 1
Echinococcus multilocularis microsomal glutathione S transferase 3 0.00872231 0.0553363 0.0553363
Brugia malayi Voltage-gated potassium channel, EAG (KCNH1)-related. C. elegans egl-2 ortholog 0.000949158 0.00329628 0.00329628
Loa Loa (eye worm) hypothetical protein 0.000634807 0.00119175 0.00119175
Echinococcus multilocularis Immunoglobulin 0.00109188 0.00425179 0.00425179
Loa Loa (eye worm) TK/KIN16 protein kinase 0.0177433 0.11573 0.11573
Schistosoma mansoni microsomal glutathione s-transferase 0.00872231 0.0553363 0.0553363
Mycobacterium tuberculosis Probable polyprenyl-diphosphate synthase GrcC2 (polyprenyl pyrophosphate synthetase) 0.003125 0.0178632 0.14972
Echinococcus multilocularis serine:threonine protein kinase 12 B 0.00553735 0.0340135 0.0340135
Echinococcus multilocularis cyclic nucleotide gated cation channel alpha 3 0.000651517 0.00130362 0.00130362
Loa Loa (eye worm) hypothetical protein 0.000651517 0.00130362 0.00130362
Brugia malayi Immunoglobulin I-set domain containing protein 0.000634807 0.00119175 0.00119175
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.00266333 0.0147724 0.0134863
Brugia malayi Peroxidasin 0.000634807 0.00119175 0.00119175
Echinococcus granulosus cyclic nucleotide gated cation channel 0.000651517 0.00130362 0.00130362
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.00266333 0.0147724 0.0134863
Schistosoma mansoni farnesyl pyrophosphate synthase 0.0123843 0.0798524 0.0798524
Leishmania major solanesyl-diphosphate synthase, putative 0.003125 0.0178632 0.0178632
Echinococcus multilocularis decaprenyl diphosphate synthase subunit 1 0.003125 0.0178632 0.0178632
Echinococcus multilocularis roundabout 2 0.00172669 0.00850172 0.00850172
Trichomonas vaginalis geranylgeranyl diphosphate synthase, putative 0.0123843 0.0798524 0.0786513
Echinococcus granulosus neuroglian 0.000634807 0.00119175 0.00119175
Entamoeba histolytica protein kinase domain containing protein 0.00553735 0.0340135 0.016444
Brugia malayi Immunoglobulin I-set domain containing protein 0.000634807 0.00119175 0.00119175
Schistosoma mansoni voltage-gated potassium channel 0.00320095 0.0183716 0.0183716
Loa Loa (eye worm) hypothetical protein 0.000634807 0.00119175 0.00119175
Brugia malayi cytochrome P450 0.00149461 0.00694797 0.00694797
Loa Loa (eye worm) hypothetical protein 0.00109188 0.00425179 0.00425179
Brugia malayi Immunoglobulin I-set domain containing protein 0.000634807 0.00119175 0.00119175
Echinococcus multilocularis hemicentin 1 0.000634807 0.00119175 0.00119175
Echinococcus granulosus peroxidasin 0.000634807 0.00119175 0.00119175
Schistosoma mansoni hypothetical protein 0.00149461 0.00694797 0.00694797
Toxoplasma gondii cytochrome p450 superfamily protein 0.00149461 0.00694797 0.0870102
Loa Loa (eye worm) hypothetical protein 0.00172669 0.00850172 0.00850172
Echinococcus granulosus lachesin 0.000634807 0.00119175 0.00119175
Brugia malayi Immunoglobulin I-set domain containing protein 0.000634807 0.00119175 0.00119175
Mycobacterium tuberculosis Possible polyprenyl synthetase IdsB (polyprenyl transferase) (polyprenyl diphosphate synthase) 0.003125 0.0178632 0.14972
Loa Loa (eye worm) N-myristoyltransferase 2 0.149826 1 1
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.000634807 0.00119175 0.00119175
Loa Loa (eye worm) hypothetical protein 0.000949158 0.00329628 0.00329628
Trichomonas vaginalis N-myristoyl transferase, putative 0.0984409 0.655988 0.655538
Schistosoma mansoni voltage-gated potassium channel 0.000537615 0.000541064 0.000541064
Giardia lamblia CDC72 0.149826 1 1
Trypanosoma cruzi N-myristoyl transferase, putative 0.149826 1 1
Trypanosoma cruzi aurora B kinase, putative 0.00553735 0.0340135 0.0272549
Echinococcus multilocularis lachesin 0.000634807 0.00119175 0.00119175
Trypanosoma brucei N-myristoyl transferase, putative 0.149826 1 1
Schistosoma mansoni voltage-gated potassium channel 0.000949158 0.00329628 0.00329628
Schistosoma mansoni roundabout 0.000634807 0.00119175 0.00119175
Echinococcus multilocularis Immunoglobulin 0.00109188 0.00425179 0.00425179
Loa Loa (eye worm) hypothetical protein 0.00249176 0.0136238 0.0136238
Loa Loa (eye worm) hypothetical protein 0.00109188 0.00425179 0.00425179
Brugia malayi serine/threonine protein kinase 6 0.00553735 0.0340135 0.0340135
Mycobacterium tuberculosis Probable geranylgeranyl pyrophosphate synthetase IdsA2 (ggppsase) (GGPP synthetase) (geranylgeranyl diphosphate synthase) 0.0123843 0.0798524 1
Schistosoma mansoni voltage-gated potassium channel 0.000949158 0.00329628 0.00329628
Echinococcus granulosus geranylgeranyl pyrophosphate synthase 0.003125 0.0178632 0.0178632
Trypanosoma cruzi N-myristoyl transferase, putative 0.149826 1 1
Mycobacterium ulcerans polyprenyl synthetase IdsB 0.003125 0.0178632 0.14972
Leishmania major farnesyl pyrophosphate synthase 0.0123843 0.0798524 0.0798524
Brugia malayi Polyprenyl synthetase family protein 0.0123843 0.0798524 0.0798524
Echinococcus granulosus microsomal glutathione S transferase 3 0.00872231 0.0553363 0.0553363
Trypanosoma cruzi farnesyl pyrophosphate synthase 0.0123843 0.0798524 0.0734145
Toxoplasma gondii MAPEG family protein 0.00872231 0.0553363 0.692982
Echinococcus multilocularis glycylpeptide N tetradecanoyltransferase 0.149826 1 1
Schistosoma mansoni trans-prenyltransferase 0.003125 0.0178632 0.0178632
Echinococcus granulosus cyclic nucleotide gated cation channel alpha 3 0.000651517 0.00130362 0.00130362
Mycobacterium tuberculosis Probable multifunctional geranylgeranyl pyrophosphate synthetase IdsA1 (GGPP synthetase) (ggppsase) (geranylgeranyl diphosphate 0.003125 0.0178632 0.14972
Brugia malayi Immunoglobulin I-set domain containing protein 0.000634807 0.00119175 0.00119175
Loa Loa (eye worm) AUR protein kinase 0.00553735 0.0340135 0.0340135
Leishmania major lanosterol 14-alpha-demethylase, putative 0.00149461 0.00694797 0.00694797
Echinococcus multilocularis roundabout 2 0.000634807 0.00119175 0.00119175
Plasmodium falciparum glycylpeptide N-tetradecanoyltransferase 0.149826 1 1
Trypanosoma brucei farnesyl pyrophosphate synthase 0.0123843 0.0798524 0.0734145
Schistosoma mansoni nephrin 0.000634807 0.00119175 0.00119175
Loa Loa (eye worm) hypothetical protein 0.000634807 0.00119175 0.00119175
Echinococcus multilocularis voltage gated potassium channel 0.000949158 0.00329628 0.00329628
Schistosoma mansoni membrane associated proteins in eicosanoid and glutathione metabolism family member 0.0259391 0.1706 0.1706
Loa Loa (eye worm) hypothetical protein 0.00109188 0.00425179 0.00425179
Leishmania major polyprenyl synthase, putative 0.003125 0.0178632 0.0178632
Brugia malayi Immunoglobulin I-set domain containing protein 0.0177433 0.11573 0.11573
Echinococcus multilocularis aurora kinase A 0.00553735 0.0340135 0.0340135
Mycobacterium leprae PROBABLE POLYPRENYL-DIPHOSPHATE SYNTHASE GRCC1 (POLYPRENYL PYROPHOSPHATE SYNTHETASE) 0.003125 0.0178632 1
Loa Loa (eye worm) CYP4Cod1 0.00149461 0.00694797 0.00694797
Schistosoma mansoni cell adhesion molecule 0.000634807 0.00119175 0.00119175
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.000634807 0.00119175 0.00119175
Loa Loa (eye worm) hypothetical protein 0.00172669 0.00850172 0.00850172
Echinococcus granulosus voltage gated potassium channel 0.000949158 0.00329628 0.00329628
Brugia malayi Cytochrome P450 family protein 0.00149461 0.00694797 0.00694797
Brugia malayi Immunoglobulin I-set domain containing protein 0.000634807 0.00119175 0.00119175
Echinococcus multilocularis hyperpolarization activated cyclic 0.000651517 0.00130362 0.00130362
Echinococcus multilocularis contactin neuroglian septate junction protein 0.000634807 0.00119175 0.00119175
Schistosoma mansoni protein kinase 0.00553735 0.0340135 0.0340135
Echinococcus granulosus defective proboscis extension response 0.00109188 0.00425179 0.00425179
Brugia malayi Fibronectin type III domain containing protein 0.00109188 0.00425179 0.00425179
Plasmodium falciparum geranylgeranyl pyrophosphate synthase, putative 0.0123843 0.0798524 0.0798524
Schistosoma mansoni hyperpolarization activated cyclic nucleotide-gated potassium channel 0.000651517 0.00130362 0.00130362
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.000634807 0.00119175 0.00119175
Loa Loa (eye worm) geranylgeranyl pyrophosphate synthetase 0.003125 0.0178632 0.0178632
Schistosoma mansoni voltage-gated potassium channel 0.000651517 0.00130362 0.00130362
Echinococcus multilocularis hemicentin 1 0.000634807 0.00119175 0.00119175
Echinococcus granulosus hemicentin 1 0.000634807 0.00119175 0.00119175
Loa Loa (eye worm) hypothetical protein 0.000634807 0.00119175 0.00119175
Echinococcus granulosus cyclic nucleotide gated cation channel 0.000651517 0.00130362 0.00130362
Loa Loa (eye worm) cytochrome P450 family protein 0.00149461 0.00694797 0.00694797
Echinococcus granulosus glycylpeptide N tetradecanoyltransferase 0.149826 1 1
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.000651517 0.00130362 0.00130362
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.000949158 0.00329628 0.00329628
Echinococcus multilocularis farnesyl pyrophosphate synthase 0.0123843 0.0798524 0.0798524
Wolbachia endosymbiont of Brugia malayi geranylgeranyl pyrophosphate synthase 0.003125 0.0178632 0.5
Echinococcus granulosus potassium voltage gated channel subfamily H 0.0029033 0.016379 0.016379
Chlamydia trachomatis geranylgeranyl pyrophosphate synthase 0.003125 0.0178632 0.5
Echinococcus multilocularis basement membrane specific heparan sulfate 0.00109188 0.00425179 0.00425179
Loa Loa (eye worm) cytochrome P450 0.00149461 0.00694797 0.00694797
Echinococcus multilocularis geranylgeranyl pyrophosphate synthase 0.003125 0.0178632 0.0178632
Echinococcus granulosus neurotracting:lsamp:neurotrimin:obcam 0.00144784 0.0066349 0.0066349
Trypanosoma cruzi farnesyl pyrophosphate synthase, putative 0.0123843 0.0798524 0.0734145
Schistosoma mansoni glutathione synthetase 0.003125 0.0178632 0.0178632
Echinococcus multilocularis roundabout 2 0.000634807 0.00119175 0.00119175
Echinococcus granulosus aurora kinase A 0.00553735 0.0340135 0.0340135
Schistosoma mansoni geranylgeranyl pyrophosphate synthase 0.003125 0.0178632 0.0178632
Echinococcus multilocularis neuroglian 0.00137073 0.00611862 0.00611862
Giardia lamblia Farnesyl diphosphate synthase 0.0123843 0.0798524 0.047453
Schistosoma mansoni defective proboscis extension response (dpr)-related 0.00109188 0.00425179 0.00425179
Loa Loa (eye worm) voltage and ligand gated potassium channel 0.0029033 0.016379 0.016379
Echinococcus granulosus hyperpolarization activated cyclic 0.000651517 0.00130362 0.00130362
Echinococcus multilocularis neurotracting:lsamp:neurotrimin:obcam 0.000634807 0.00119175 0.00119175
Brugia malayi N-myristoyltransferase 2 0.149826 1 1
Schistosoma mansoni cytochrome P450 0.00149461 0.00694797 0.00694797
Echinococcus multilocularis prenyl (decaprenyl) diphosphate synthase 0.003125 0.0178632 0.0178632
Loa Loa (eye worm) hypothetical protein 0.000634807 0.00119175 0.00119175
Echinococcus granulosus roundabout 2 0.00172669 0.00850172 0.00850172
Loa Loa (eye worm) hypothetical protein 0.00109188 0.00425179 0.00425179
Echinococcus granulosus contactin 0.000634807 0.00119175 0.00119175
Entamoeba histolytica protein kinase, putative 0.00553735 0.0340135 0.016444
Schistosoma mansoni receptor tyrosine phosphatase type r2a 0.000634807 0.00119175 0.00119175
Loa Loa (eye worm) cyclic-nucleotide gated cation channel 0.000651517 0.00130362 0.00130362
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.000651517 0.00130362 0.00130362
Schistosoma mansoni vesicular amine transporter 0.00133186 0.00585838 0.00585838
Entamoeba histolytica protein kinase , putative 0.00553735 0.0340135 0.016444
Trypanosoma brucei solanesyl-diphosphate synthase, putative 0.003125 0.0178632 0.0109916
Echinococcus granulosus twitchin 0.00141598 0.00642158 0.00642158
Loa Loa (eye worm) cyclic-nucleotide gated cation channel 0.000651517 0.00130362 0.00130362
Echinococcus multilocularis peroxidasin 0.000634807 0.00119175 0.00119175
Loa Loa (eye worm) hypothetical protein 0.000634807 0.00119175 0.00119175
Echinococcus granulosus hyperpolarization activated cyclic 0.000651517 0.00130362 0.00130362
Echinococcus multilocularis hyperpolarization activated cyclic 0.000651517 0.00130362 0.00130362
Brugia malayi Polyprenyl synthetase family protein 0.003125 0.0178632 0.0178632
Echinococcus granulosus potassium:sodium hyperpolarization activated 0.000651517 0.00130362 0.00130362
Loa Loa (eye worm) hypothetical protein 0.000634807 0.00119175 0.00119175
Mycobacterium ulcerans polyprenyl diphosphate synthetase, GrcC1 0.003125 0.0178632 0.14972
Toxoplasma gondii polyprenyl synthetase superfamily protein 0.003125 0.0178632 0.223703
Entamoeba histolytica glycylpeptide N-tetradecanoyltransferase, putative 0.149826 1 1
Trichomonas vaginalis AGC family protein kinase 0.00553735 0.0340135 0.0327525
Echinococcus granulosus farnesyl pyrophosphate synthase 0.0123843 0.0798524 0.0798524
Brugia malayi Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog 0.0029033 0.016379 0.016379
Echinococcus multilocularis receptor type tyrosine protein phosphatase F 0.000634807 0.00119175 0.00119175
Plasmodium falciparum octaprenyl pyrophosphate synthase 0.003125 0.0178632 0.0178632
Schistosoma mansoni N-myristoyltransferase 0.149826 1 1
Trichomonas vaginalis geranylgeranyl pyrophosphate synthase, putative 0.0123843 0.0798524 0.0786513
Brugia malayi geranylgeranyl pyrophosphate synthetase 0.003125 0.0178632 0.0178632
Echinococcus granulosus cytochrome P450 2K1 0.00149461 0.00694797 0.00694797
Brugia malayi serine/threonine-protein kinase 6 0.00553735 0.0340135 0.0340135
Echinococcus multilocularis potassium voltage gated channel subfamily H 0.0029033 0.016379 0.016379
Leishmania major cytochrome p450-like protein 0.00149461 0.00694797 0.00694797
Plasmodium vivax glycylpeptide N-tetradecanoyltransferase, putative 0.149826 1 1
Schistosoma mansoni cyclic-nucleotide-gated cation channel 0.000651517 0.00130362 0.00130362
Trypanosoma cruzi polyprenyl synthase, putative 0.003125 0.0178632 0.0109916
Echinococcus granulosus potassium voltage gated channel subfamily H 0.000949158 0.00329628 0.00329628
Toxoplasma gondii polyprenyl synthetase superfamily protein 0.0123843 0.0798524 1
Schistosoma mansoni cell adhesion molecule 0.000634807 0.00119175 0.00119175
Schistosoma mansoni nephrin 0.00137073 0.00611862 0.00611862
Plasmodium vivax serine/threonine protein kinase 6, putative 0.00553735 0.0340135 0.016444
Schistosoma mansoni tyrosine kinase 0.000734018 0.00185595 0.00185595
Schistosoma mansoni 60S ribosomal protein L21 0.000537615 0.000541064 0.000541064
Entamoeba histolytica serine/threonine- protein kinase 6 , putative 0.00553735 0.0340135 0.016444
Entamoeba histolytica protein kinase, putative 0.00553735 0.0340135 0.016444
Echinococcus multilocularis 0.00149461 0.00694797 0.00694797
Brugia malayi Cytochrome P450 family protein 0.00149461 0.00694797 0.00694797
Loa Loa (eye worm) hypothetical protein 0.000634807 0.00119175 0.00119175
Schistosoma mansoni voltage-gated potassium channel 0.00320095 0.0183716 0.0183716
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.000634807 0.00119175 0.00119175
Trypanosoma cruzi solanesyl-diphosphate synthase 0.003125 0.0178632 0.0109916
Echinococcus multilocularis potassium:sodium hyperpolarization activated 0.000651517 0.00130362 0.00130362
Leishmania major cytochrome p450-like protein 0.00149461 0.00694797 0.00694797
Trypanosoma cruzi solanesyl-diphosphate synthase, putative 0.003125 0.0178632 0.0109916
Schistosoma mansoni Neurotrimin precursor (hNT) 0.00109188 0.00425179 0.00425179
Loa Loa (eye worm) CAMK/MLCK protein kinase 0.000680059 0.00149471 0.00149471
Loa Loa (eye worm) polyprenyl synthetase 0.0123843 0.0798524 0.0798524
Wolbachia endosymbiont of Brugia malayi geranylgeranyl pyrophosphate synthase 0.003125 0.0178632 0.5
Echinococcus granulosus decaprenyl diphosphate synthase subunit 1 0.003125 0.0178632 0.0178632
Trypanosoma cruzi polyprenyl synthase, putative 0.003125 0.0178632 0.0109916
Echinococcus granulosus Immunoglobulin 0.00109188 0.00425179 0.00425179
Brugia malayi hypothetical protein 0.00109188 0.00425179 0.00425179
Brugia malayi serine/threonine kinase 12 0.00553735 0.0340135 0.0340135
Brugia malayi Cyclic-nucleotide gated cation channel 0.000651517 0.00130362 0.00130362
Plasmodium vivax geranylgeranyl pyrophosphate synthase 0.0123843 0.0798524 0.0631167
Loa Loa (eye worm) hypothetical protein 0.00144784 0.0066349 0.0066349
Trichomonas vaginalis geranylgeranyl pyrophosphate synthase, putative 0.0123843 0.0798524 0.0786513
Echinococcus granulosus tyrosine protein kinase otk 0.000634807 0.00119175 0.00119175
Brugia malayi Immunoglobulin I-set domain containing protein 0.00109188 0.00425179 0.00425179
Schistosoma mansoni septate junction protein 0.000634807 0.00119175 0.00119175
Echinococcus granulosus roundabout 2 0.000634807 0.00119175 0.00119175
Echinococcus granulosus prenyl decaprenyl diphosphate synthase 0.003125 0.0178632 0.0178632
Leishmania major cytochrome p450-like protein 0.00149461 0.00694797 0.00694797
Loa Loa (eye worm) polyprenyl synthetase 0.003125 0.0178632 0.0178632
Entamoeba histolytica serine/threonine- protein kinase 6, putative 0.00553735 0.0340135 0.016444
Trichomonas vaginalis AGC family protein kinase 0.00553735 0.0340135 0.0327525
Echinococcus granulosus serine:threonine protein kinase 12 B 0.00553735 0.0340135 0.0340135
Schistosoma mansoni septate junction protein 0.000634807 0.00119175 0.00119175
Schistosoma mansoni titin 0.000634807 0.00119175 0.00119175
Schistosoma mansoni neurotracting/lsamp/neurotrimin/obcam related cell adhesion molecule 0.000634807 0.00119175 0.00119175
Brugia malayi hypothetical protein 0.0350191 0.231389 0.231389
Echinococcus multilocularis neuroglian 0.000634807 0.00119175 0.00119175
Brugia malayi Immunoglobulin I-set domain containing protein 0.000634807 0.00119175 0.00119175
Trypanosoma cruzi solanesyl-diphosphate synthase, putative 0.003125 0.0178632 0.0109916
Treponema pallidum octaprenyl-diphosphate synthase 0.003125 0.0178632 0.5
Echinococcus multilocularis tyrosine protein kinase otk 0.000634807 0.00119175 0.00119175
Leishmania major N-myristoyl transferase, putative 0.149826 1 1
Brugia malayi Prion-like- 0.000634807 0.00119175 0.00119175
Schistosoma mansoni serine/threonine protein kinase 0.00553735 0.0340135 0.0340135
Echinococcus multilocularis cyclic nucleotide gated cation channel 0.000651517 0.00130362 0.00130362
Loa Loa (eye worm) immunoglobulin I-set domain-containing protein 0.000634807 0.00119175 0.00119175
Echinococcus granulosus neuroglian 0.00137073 0.00611862 0.00611862

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 0.1 uM Inhibition of His6-tagged human truncated FPPS (6-353) expressed in Escherichia coli BL21(DE3) cells using geranyl diphosphate and isopentenyl diphosphate as substrate preincubated with enzyme for 30 mins by spectrophotometric analysis ChEMBL. 23610597
IC50 (binding) = 0.11 uM Binding affinity to human FPPS at 1 mM by X-ray crystallographic analysis ChEMBL. 23610597
IC50 (functional) = 1.3 uM Inhibition of Plasmodium falciparum growth after 72 hrs by LDH assay ChEMBL. 23610597

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23 23610597

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

Bibliographic References

1 literature reference was collected for this gene.

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