Detailed information for compound 1281959

Basic information

Technical information
  • TDR Targets ID: 1281959
  • Name: 2-hydroxy-2,2-di(phenyl)-N'-propylacetohydraz ide
  • MW: 284.353 | Formula: C17H20N2O2
  • H donors: 3 H acceptors: 2 LogP: 2.72 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 1
  • SMILES: CCCNNC(=O)C(c1ccccc1)(c1ccccc1)O
  • InChi: 1S/C17H20N2O2/c1-2-13-18-19-16(20)17(21,14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-12,18,21H,2,13H2,1H3,(H,19,20)
  • InChiKey: VHXVQVYPRKPNKA-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-hydroxy-2,2-di(phenyl)-N'-propyl-acetohydrazide
  • 2-hydroxy-2,2-di(phenyl)-N'-propyl-ethanehydrazide
  • MLS000552310
  • SMR000177682
  • BAS 02751599
  • Hydroxy-diphenyl-acetic acid N'-propyl-hydrazide
  • ZINC05008049

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens l(3)mbt-like 1 (Drosophila) Starlite/ChEMBL No references
Homo sapiens lamin A/C Starlite/ChEMBL No references
Homo sapiens huntingtin Starlite/ChEMBL No references
Homo sapiens GNAS complex locus Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Schistosoma japonicum Lamin-C, putative Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma mansoni lamin Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma japonicum expressed protein Get druggable targets OG5_128723 All targets in OG5_128723
Brugia malayi intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus granulosus lamin dm0 Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus granulosus guanine nucleotide binding protein Gs subunit Get druggable targets OG5_131088 All targets in OG5_131088
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_132837 All targets in OG5_132837
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Onchocerca volvulus Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum expressed protein Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum ko:K07611 lamin, putative Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma mansoni lamin Get druggable targets OG5_128723 All targets in OG5_128723
Onchocerca volvulus Huntingtin homolog Get druggable targets OG5_132837 All targets in OG5_132837
Loa Loa (eye worm) intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum ko:K04632 guanine nucleotide binding protein (G protein), alpha stimulating, putative Get druggable targets OG5_131088 All targets in OG5_131088
Onchocerca volvulus Huntingtin homolog Get druggable targets OG5_132837 All targets in OG5_132837
Schistosoma mansoni intermediate filament proteins Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus multilocularis lamin dm0 Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus multilocularis lamin Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) intermediate filament tail domain-containing protein Get druggable targets OG5_128723 All targets in OG5_128723
Onchocerca volvulus Get druggable targets OG5_128723 All targets in OG5_128723
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative Get druggable targets OG5_131088 All targets in OG5_131088
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_132837 All targets in OG5_132837
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
Echinococcus granulosus cytoplasmic intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus multilocularis endonuclease exonuclease phosphatase Get druggable targets OG5_130415 All targets in OG5_130415
Schistosoma japonicum Lethal(3)malignant brain tumor-like 4 protein, putative Get druggable targets OG5_130415 All targets in OG5_130415
Schistosoma japonicum Intermediate filament protein ifa-1, putative Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma mansoni hypothetical protein Get druggable targets OG5_130415 All targets in OG5_130415
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus granulosus lamin Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus granulosus endonuclease exonuclease phosphatase Get druggable targets OG5_130415 All targets in OG5_130415
Echinococcus multilocularis musashi Get druggable targets OG5_128723 All targets in OG5_128723
Brugia malayi Intermediate filament tail domain containing protein Get druggable targets OG5_128723 All targets in OG5_128723
Schistosoma japonicum Lethal(3)malignant brain tumor-like 3 protein, putative Get druggable targets OG5_130415 All targets in OG5_130415
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain Get druggable targets OG5_131088 All targets in OG5_131088
Brugia malayi hypothetical protein Get druggable targets OG5_132837 All targets in OG5_132837
Echinococcus granulosus intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus multilocularis cytoplasmic intermediate filament protein Get druggable targets OG5_128723 All targets in OG5_128723
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit Get druggable targets OG5_131088 All targets in OG5_131088
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Schistosoma mansoni GTP-binding protein alpha subunit gna GNAS complex locus 394 aa 450 aa 28.7 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus multilocularis histone acetyltransferase MYST2 0.0066 0.0178 0.0123
Brugia malayi intermediate filament protein 0.0033 0.0056 0.0056
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.0058 0.0149 0.217
Brugia malayi hypothetical protein 0.0148 0.0483 0.0483
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0066 0.0178 0.0123
Schistosoma mansoni serine/threonine protein kinase 0.2719 1 1
Loa Loa (eye worm) hypothetical protein 0.0148 0.0483 0.0483
Loa Loa (eye worm) intermediate filament protein 0.0033 0.0056 0.0056
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0055 0.014 0.014
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0227 0.0776 0.0724
Brugia malayi Intermediate filament tail domain containing protein 0.0033 0.0056 0.0056
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.014 0.0084
Echinococcus granulosus polycomb protein SCMH1 0.0058 0.0149 0.0093
Echinococcus multilocularis SAM and MBT domain containing protein 0.0058 0.0149 0.0093
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0066 0.0178 0.0178
Echinococcus granulosus histone acetyltransferase MYST2 0.0066 0.0178 0.0123
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.014 0.0084
Brugia malayi mbt repeat family protein 0.0058 0.0149 0.0149
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.014 0.0084
Onchocerca volvulus 0.0058 0.0149 0.217
Brugia malayi mbt repeat family protein 0.0058 0.0149 0.0149
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.014 0.0084
Loa Loa (eye worm) hypothetical protein 0.0033 0.0056 0.0056
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0055 0.014 0.0084
Echinococcus granulosus SAM and MBT domain containing protein 0.0058 0.0149 0.0093
Echinococcus multilocularis polycomb protein SCMH1 0.0058 0.0149 0.0093
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0033 0.0056 0.0056
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0055 0.014 0.0084
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0058 0.0149 0.0093
Schistosoma mansoni myelin transcription factor 1 myt1 0.0066 0.0178 0.0123
Schistosoma mansoni hypothetical protein 0.035 0.1232 0.1182
Onchocerca volvulus Huntingtin homolog 0.0148 0.0483 1
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0055 0.014 0.014
Schistosoma mansoni sex comb on midleg homolog 0.0058 0.0149 0.0093
Loa Loa (eye worm) hypothetical protein 0.0058 0.0149 0.0149
Schistosoma mansoni sex comb on midleg homolog 0.0058 0.0149 0.0093
Echinococcus granulosus MAP kinase activated protein kinase 2 0.2719 1 1
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0066 0.0178 0.0123
Loa Loa (eye worm) hypothetical protein 0.0066 0.0178 0.0178
Loa Loa (eye worm) hypothetical protein 0.0148 0.0483 0.0483
Loa Loa (eye worm) camk/mapkapk/mapkapk protein kinase 0.2719 1 1
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0055 0.014 0.0084
Loa Loa (eye worm) mbt repeat family protein 0.0058 0.0149 0.0149
Loa Loa (eye worm) hypothetical protein 0.0032 0.0054 0.0054
Echinococcus multilocularis MAP kinase activated protein kinase 2 0.2719 1 1
Loa Loa (eye worm) MBCTL1 0.0066 0.0178 0.0178
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0227 0.0776 0.0724
Onchocerca volvulus Huntingtin homolog 0.0148 0.0483 1

Activities

Activity type Activity value Assay description Source Reference
Potency (functional) = 0.0708 um PUBCHEM_BIOASSAY: qHTS Assay for Modulators of Lamin A Splicing. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) = 0.7079 um PUBCHEM_BIOASSAY: qHTS Assay for the Inhibitors of L3MBTL1. (Class of assay: confirmatory) [Related pubchem assays: 485292 (Probe Development Summary for Inhibitors of L3MBTL1)] ChEMBL. No reference
Potency (functional) = 1.9953 um PUBCHEM_BIOASSAY: qHTS Multiplex Assay to Identify Dual Action Probes in a Cell Model of Huntington: Aggregate Formation (GFP). (Class of assay: confirmatory) [Related pubchem assays: 1482, 1471 ] ChEMBL. No reference
Potency (functional) 10.4179 uM PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850] ChEMBL. No reference
Potency (functional) 11.2202 uM PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory) ChEMBL. No reference

Phenotypes

Whole-cell/tissue/organism interactions

Species name Source Reference Is orphan
Plasmodium falciparum ChEMBL23

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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