Detailed information for compound 176301

Basic information

Technical information
  • TDR Targets ID: 176301
  • Name: 1,3-diphenylpropylphosphonic acid
  • MW: 276.267 | Formula: C15H17O3P
  • H donors: 2 H acceptors: 3 LogP: 2.24 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: OP(=O)(C(c1ccccc1)CCc1ccccc1)O
  • InChi: 1S/C15H17O3P/c16-19(17,18)15(14-9-5-2-6-10-14)12-11-13-7-3-1-4-8-13/h1-10,15H,11-12H2,(H2,16,17,18)
  • InChiKey: GKEBQWSROZOYSD-UHFFFAOYSA-N  

Network

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Synonyms

  • 1,3-di(phenyl)propylphosphonic acid

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens acid phosphatase, prostate Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Trichomonas vaginalis conserved hypothetical protein Get druggable targets OG5_127341 All targets in OG5_127341
Leishmania mexicana membrane-bound acid phosphatase 2, putative Get druggable targets OG5_127341 All targets in OG5_127341
Schistosoma mansoni acid phosphatase-related Get druggable targets OG5_127341 All targets in OG5_127341
Trichomonas vaginalis conserved hypothetical protein Get druggable targets OG5_127341 All targets in OG5_127341
Trichomonas vaginalis histidine acid phosphatase, putative Get druggable targets OG5_127341 All targets in OG5_127341
Trichomonas vaginalis acid phosphatase, putative Get druggable targets OG5_127341 All targets in OG5_127341
Trichomonas vaginalis acid phosphatase, putative Get druggable targets OG5_127341 All targets in OG5_127341
Entamoeba histolytica histidine acid phosphatase family protein Get druggable targets OG5_127341 All targets in OG5_127341
Leishmania infantum membrane-bound acid phosphatase 2, putative Get druggable targets OG5_127341 All targets in OG5_127341
Schistosoma japonicum ko:K01078 acid phosphatase [EC3.1.3.2], putative Get druggable targets OG5_127341 All targets in OG5_127341
Trichomonas vaginalis conserved hypothetical protein Get druggable targets OG5_127341 All targets in OG5_127341
Leishmania braziliensis membrane-bound acid phosphatase 2 Get druggable targets OG5_127341 All targets in OG5_127341
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127341 All targets in OG5_127341
Trypanosoma cruzi membrane-bound acid phosphatase 2, putative Get druggable targets OG5_127341 All targets in OG5_127341
Trichomonas vaginalis conserved hypothetical protein Get druggable targets OG5_127341 All targets in OG5_127341
Trichomonas vaginalis conserved hypothetical protein Get druggable targets OG5_127341 All targets in OG5_127341
Leishmania mexicana membrane-bound acid phosphatase 2 Get druggable targets OG5_127341 All targets in OG5_127341
Trypanosoma brucei membrane-bound acid phosphatase 2 Get druggable targets OG5_127341 All targets in OG5_127341
Entamoeba histolytica histidine acid phosphatase family protein Get druggable targets OG5_127341 All targets in OG5_127341
Leishmania major membrane-bound acid phosphatase 2, putative Get druggable targets OG5_127341 All targets in OG5_127341
Leishmania major membrane-bound acid phosphatase 2 Get druggable targets OG5_127341 All targets in OG5_127341
Trypanosoma congolense membrane-bound acid phosphatase 2 Get druggable targets OG5_127341 All targets in OG5_127341
Trichomonas vaginalis acid phosphatase, putative Get druggable targets OG5_127341 All targets in OG5_127341
Trichomonas vaginalis acid phosphatase, putative Get druggable targets OG5_127341 All targets in OG5_127341
Trypanosoma brucei gambiense membrane-bound acid phosphatase 1 precursor, putative Get druggable targets OG5_127341 All targets in OG5_127341
Trypanosoma cruzi membrane-bound acid phosphatase 2, putative Get druggable targets OG5_127341 All targets in OG5_127341
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127341 All targets in OG5_127341
Trichomonas vaginalis prostatic acid phosphatase, putative Get druggable targets OG5_127341 All targets in OG5_127341
Trypanosoma brucei membrane-bound acid phosphatase 1 precursor Get druggable targets OG5_127341 All targets in OG5_127341
Echinococcus granulosus lysosomal acid phosphatase Get druggable targets OG5_127341 All targets in OG5_127341
Trypanosoma cruzi membrane-bound acid phosphatase 2, putative Get druggable targets OG5_127341 All targets in OG5_127341
Leishmania donovani membrane-bound acid phosphatase 2 Get druggable targets OG5_127341 All targets in OG5_127341
Leishmania donovani membrane-bound acid phosphatase 2, putative Get druggable targets OG5_127341 All targets in OG5_127341
Echinococcus multilocularis lysosomal acid phosphatase Get druggable targets OG5_127341 All targets in OG5_127341
Schistosoma japonicum Testicular acid phosphatase homolog precursor, putative Get druggable targets OG5_127341 All targets in OG5_127341
Trichomonas vaginalis conserved hypothetical protein Get druggable targets OG5_127341 All targets in OG5_127341
Trichomonas vaginalis conserved hypothetical protein Get druggable targets OG5_127341 All targets in OG5_127341
Trichomonas vaginalis Lysophosphatidic acid phosphatase type 6 precursor, putative Get druggable targets OG5_127341 All targets in OG5_127341
Schistosoma japonicum Lysosomal acid phosphatase precursor, putative Get druggable targets OG5_127341 All targets in OG5_127341
Trichomonas vaginalis acid phosphatase, putative Get druggable targets OG5_127341 All targets in OG5_127341
Trichomonas vaginalis acid phosphatase, putative Get druggable targets OG5_127341 All targets in OG5_127341
Schistosoma mansoni prostatic acid phosphatase Get druggable targets OG5_127341 All targets in OG5_127341
Echinococcus multilocularis lysosomal acid phosphatase Get druggable targets OG5_127341 All targets in OG5_127341
Trichomonas vaginalis conserved hypothetical protein Get druggable targets OG5_127341 All targets in OG5_127341
Leishmania infantum membrane-bound acid phosphatase 2 Get druggable targets OG5_127341 All targets in OG5_127341
Echinococcus multilocularis lysosomal acid phosphatase Get druggable targets OG5_127341 All targets in OG5_127341
Trichomonas vaginalis conserved hypothetical protein Get druggable targets OG5_127341 All targets in OG5_127341
Trichomonas vaginalis testicular acid phosphatase, putative Get druggable targets OG5_127341 All targets in OG5_127341
Echinococcus multilocularis lysosomal acid phosphatase Get druggable targets OG5_127341 All targets in OG5_127341
Echinococcus granulosus lysosomal acid phosphatase Get druggable targets OG5_127341 All targets in OG5_127341
Onchocerca volvulus Get druggable targets OG5_127341 All targets in OG5_127341
Giardia lamblia Lysosomal acid phosphatase precursor Get druggable targets OG5_127341 All targets in OG5_127341
Trypanosoma brucei gambiense membrane-bound acid phosphatase 2, putative Get druggable targets OG5_127341 All targets in OG5_127341
Leishmania braziliensis membrane-bound acid phosphatase 2, putative Get druggable targets OG5_127341 All targets in OG5_127341
Trichomonas vaginalis conserved hypothetical protein Get druggable targets OG5_127341 All targets in OG5_127341
Trichomonas vaginalis conserved hypothetical protein Get druggable targets OG5_127341 All targets in OG5_127341
Trichomonas vaginalis conserved hypothetical protein Get druggable targets OG5_127341 All targets in OG5_127341
Brugia malayi Histidine acid phosphatase family protein Get druggable targets OG5_127341 All targets in OG5_127341

By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Leishmania major membrane-bound acid phosphatase precursor acid phosphatase, prostate 386 aa 315 aa 27.9 %

Obtained from network model

Ranking Plot


Putative Targets List


Species Potential target Raw Global Species
Leishmania major cathepsin L-like protease 0.0212 0.0283 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0212 0.0283 0.0461
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0212 0.0283 1
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0212 0.0283 0.418
Trypanosoma cruzi cysteine peptidase, putative 0.0212 0.0283 0.418
Onchocerca volvulus Cathepsin F homolog 0.0212 0.0283 1
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0349 0.0676 0.0676
Plasmodium vivax dipeptidyl aminopeptidase 3, putative 0.1393 0.3675 0.3675
Onchocerca volvulus Cathepsin L homolog 0.0212 0.0283 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0212 0.0283 1
Plasmodium falciparum cysteine proteinase falcipain 3 0.0212 0.0283 0.0283
Trypanosoma cruzi cysteine peptidase C (CPC), putative 0.014 0.0076 0.1124
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0212 0.0283 0.0461
Brugia malayi cathepsin B-like cysteine proteinase 0.0349 0.0676 1
Schistosoma mansoni cathepsin F (C01 family) 0.0212 0.0283 0.0283
Brugia malayi Cathepsin L-like cysteine proteinase 0.0145 0.009 0.133
Loa Loa (eye worm) cysteine protease 0.0212 0.0283 0.3442
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0212 0.0283 0.0461
Entamoeba histolytica cysteine protease, putative 0.0212 0.0283 1
Trypanosoma cruzi cysteine peptidase C (CPC), putative 0.0349 0.0676 1
Leishmania major cathepsin L-like protease 0.0212 0.0283 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0212 0.0283 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0212 0.0283 0.0461
Echinococcus multilocularis cathepsin b 0.0349 0.0676 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0212 0.0283 0.0461
Loa Loa (eye worm) Papain cysteine protease/cathepsin propeptide inhibitor-containing protein 0.0212 0.0283 0.3442
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0212 0.0283 0.0461
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0212 0.0283 0.0461
Loa Loa (eye worm) fibroinase 0.0212 0.0283 0.3442
Onchocerca volvulus 0.0212 0.0283 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0212 0.0283 0.0461
Echinococcus granulosus cathepsin l1 0.0212 0.0283 0.418
Loa Loa (eye worm) hypothetical protein 0.0349 0.0676 1
Echinococcus granulosus cathepsin l cysteine peptidase 0.0212 0.0283 0.418
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0212 0.0283 0.3442
Schistosoma mansoni cathepsin F (C01 family) 0.0212 0.0283 0.0283
Echinococcus multilocularis cathepsin b 0.0349 0.0676 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0212 0.0283 0.0461
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0145 0.009 0.0147
Brugia malayi Cathepsin L-like precursor 0.0212 0.0283 0.418
Schistosoma mansoni SmCB2 peptidase (C01 family) 0.0349 0.0676 0.0676
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0212 0.0283 0.0461
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0212 0.0283 0.0461
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0212 0.0283 1
Trichomonas vaginalis Clan CA, family C1, cathepsin B-like cysteine peptidase 0.2248 0.6132 1
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0212 0.0283 0.418
Schistosoma mansoni dipeptidyl-peptidase I (C01 family) 0.3593 1 1
Onchocerca volvulus 0.0212 0.0283 1
Plasmodium falciparum dipeptidyl aminopeptidase 1 0.3593 1 1
Plasmodium vivax dipeptidyl aminopeptidase 1, putative 0.3593 1 1
Onchocerca volvulus 0.0212 0.0283 1
Trypanosoma brucei cysteine peptidase C (CPC) 0.014 0.0076 0.269
Brugia malayi Cathepsin L-like precursor 0.0145 0.009 0.133
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0145 0.009 0.0147
Giardia lamblia Dipeptidyl-peptidase I precursor 0.1393 0.3675 0.3626
Entamoeba histolytica cysteine proteinase, putative 0.0145 0.009 0.3182
Leishmania major cathepsin L-like protease 0.0212 0.0283 1
Brugia malayi Cathepsin L-like precursor 0.0212 0.0283 0.418
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0212 0.0283 0.0461
Entamoeba histolytica cysteine proteinase, putative 0.0212 0.0283 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0212 0.0283 0.0461
Echinococcus granulosus cathepsin b 0.0349 0.0676 1
Trichomonas vaginalis Clan CA, family C1, cathepsin B-like cysteine peptidase 0.014 0.0076 0.0124
Toxoplasma gondii cathepsin CPL 0.0212 0.0283 0.0208
Echinococcus multilocularis cysteine protease 0.0212 0.0283 0.418
Echinococcus multilocularis cathepsin L cysteine protease 0.0212 0.0283 0.418
Giardia lamblia Dipeptidyl-peptidase I precursor 0.1393 0.3675 0.3626
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0212 0.0283 0.0461
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0212 0.0283 1
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0212 0.0283 0.0461
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0212 0.0283 0.0461
Echinococcus granulosus cathepsin l1 0.0145 0.009 0.133
Echinococcus granulosus cathepsin L cysteine proteinase 0.0212 0.0283 0.418
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0212 0.0283 1
Plasmodium falciparum cysteine proteinase falcipain 2a 0.0212 0.0283 0.0283
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0212 0.0283 0.0461
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0212 0.0283 0.0461
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0212 0.0283 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0212 0.0283 1
Loa Loa (eye worm) hypothetical protein 0.0145 0.009 0.0232
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0212 0.0283 1
Leishmania major cathepsin L-like protease 0.0212 0.0283 1
Plasmodium falciparum dipeptidyl aminopeptidase 2 0.3593 1 1
Leishmania major cathepsin L-like protease 0.0212 0.0283 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0212 0.0283 0.0461
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0212 0.0283 1
Toxoplasma gondii cathepsin CPC2 0.1393 0.3675 0.3626
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0212 0.0283 0.0461
Toxoplasma gondii cathepsin CPC1 0.3593 1 1
Entamoeba histolytica cysteine proteinase, putative 0.0212 0.0283 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0212 0.0283 0.0461
Onchocerca volvulus 0.0212 0.0283 1
Echinococcus multilocularis cathepsin L cysteine protease 0.0212 0.0283 0.418
Brugia malayi Cathepsin L-like precursor 0.0212 0.0283 0.418
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0349 0.0676 0.0676
Onchocerca volvulus 0.0212 0.0283 1
Loa Loa (eye worm) ctsf protein 0.0212 0.0283 0.3442
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0349 0.0676 0.0676
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0212 0.0283 0.0461
Brugia malayi Cathepsin L-like precursor 0.0212 0.0283 0.418
Plasmodium vivax vivapain-2 0.0212 0.0283 0.0283
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0212 0.0283 0.0461
Leishmania major cathepsin L-like protease 0.0212 0.0283 1
Plasmodium vivax vivapain-2 0.0212 0.0283 0.0283
Brugia malayi Cathepsin L-like precursor 0.0145 0.009 0.133
Brugia malayi Papain family cysteine protease containing protein 0.0212 0.0283 0.418
Brugia malayi cathepsin L-like precursor 0.0145 0.009 0.133
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.014 0.0076 0.0076
Loa Loa (eye worm) hypothetical protein 0.0145 0.009 0.0232
Echinococcus granulosus cathepsin b 0.0349 0.0676 1
Plasmodium vivax dipeptidyl aminopeptidase 2, putative 0.3593 1 1
Trypanosoma cruzi cysteine peptidase, putative 0.0212 0.0283 0.418
Onchocerca volvulus 0.0212 0.0283 1
Brugia malayi Cathepsin L-like precursor 0.0212 0.0283 0.418
Leishmania major cathepsin L-like protease 0.0212 0.0283 1
Brugia malayi Cathepsin L-like precursor 0.0212 0.0283 0.418
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0212 0.0283 0.0461
Plasmodium falciparum cysteine proteinase falcipain 2b 0.0212 0.0283 0.0283
Leishmania major cathepsin L-like protease 0.0212 0.0283 1
Leishmania major cysteine peptidase A (CPA) 0.0212 0.0283 1
Loa Loa (eye worm) hypothetical protein 0.0212 0.0283 0.3442
Schistosoma mansoni cathepsin F (C01 family) 0.0145 0.009 0.009
Onchocerca volvulus Cathepsin L homolog 0.0212 0.0283 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0212 0.0283 0.0461
Giardia lamblia Encystation-specific protease 0.1393 0.3675 0.3626
Plasmodium falciparum dipeptidyl aminopeptidase 3 0.1393 0.3675 0.3675
Trypanosoma cruzi cysteine peptidase, putative 0.0212 0.0283 0.418
Onchocerca volvulus 0.0212 0.0283 1
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.0145 0.009 0.133
Loa Loa (eye worm) hypothetical protein 0.0145 0.009 0.0232
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0212 0.0283 1
Echinococcus multilocularis cysteine protease 0.0212 0.0283 0.418
Trypanosoma cruzi cysteine peptidase, putative 0.0212 0.0283 0.418
Trypanosoma cruzi cruzipain precursor, putative 0.0212 0.0283 0.418
Toxoplasma gondii preprocathepsin c precursor, putative 0.3593 1 1

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 14 uM Inhibition of human prostatic acid phosphatase was determined as inhibition of the hydrolysis of tyrosine phosphate ChEMBL. No reference
IC50 (binding) = 14 uM Inhibition of human prostatic acid phosphatase was determined as inhibition of the hydrolysis of tyrosine phosphate ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

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

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

Annotated phenotypes:

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

Bibliographic References

No literature references available for this target.

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