Detailed information for compound 903633

Basic information

Technical information
  • TDR Targets ID: 903633
  • Name: 4-(2-fluorophenyl)-3-(4-methylphenyl)-5-pheny l-1,4-dihydropyrrolo[4,3-d]pyrazol-6-one
  • MW: 383.418 | Formula: C24H18FN3O
  • H donors: 1 H acceptors: 2 LogP: 4.27 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: Cc1ccc(cc1)c1[nH]nc2c1C(c1ccccc1F)N(C2=O)c1ccccc1
  • InChi: 1S/C24H18FN3O/c1-15-11-13-16(14-12-15)21-20-22(27-26-21)24(29)28(17-7-3-2-4-8-17)23(20)18-9-5-6-10-19(18)25/h2-14,23H,1H3,(H,26,27)
  • InChiKey: RAPYASVWFDDYST-UHFFFAOYSA-N  

Network

Hover on a compound node to display the structore

Synonyms

  • Oprea1_844266
  • BAS 13119912
  • A2066/0086894
  • ChemDiv1_021812

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
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
Schistosoma mansoni receptor tyrosine phosphatase type r2a 0.0028 0.0173 0.0175
Echinococcus multilocularis 0.0028 0.0173 0.0175
Loa Loa (eye worm) hypothetical protein 0.0028 0.0173 0.0175
Loa Loa (eye worm) MH2 domain-containing protein 0.0129 0.1095 0.1105
Onchocerca volvulus 0.0028 0.0173 0.5
Trypanosoma cruzi trans-sialidase, Group I, putative 0.0296 0.2628 1
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0173 0.0175
Loa Loa (eye worm) hypothetical protein 0.0028 0.0173 0.0175
Echinococcus granulosus tyrosine protein phosphatase non receptor type 0.0028 0.0173 0.0175
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0173 0.0175
Onchocerca volvulus 0.0028 0.0173 0.5
Trypanosoma brucei mitogen activated protein kinase 4, putative 0.005 0.0373 0.0816
Loa Loa (eye worm) protein tyrosine phosphatase 0.0028 0.0173 0.0175
Loa Loa (eye worm) protein-tyrosine-phosphatase 0.0028 0.0173 0.0175
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.0028 0.0173 0.0175
Loa Loa (eye worm) hypothetical protein 0.0028 0.0173 0.0175
Trypanosoma cruzi trans-sialidase, Group I, putative 0.0296 0.2628 1
Loa Loa (eye worm) hypothetical protein 0.0028 0.0173 0.0175
Trypanosoma cruzi mitogen activated protein kinase 2, putative 0.005 0.0373 0.0816
Onchocerca volvulus 4.1 G protein, putative homolog 0.0028 0.0173 0.5
Onchocerca volvulus 0.0028 0.0173 0.5
Echinococcus multilocularis receptor type tyrosine protein phosphatase protein tyrosine phosphatase receptor type 0.0028 0.0173 0.0175
Loa Loa (eye worm) hypothetical protein 0.0028 0.0173 0.0175
Echinococcus multilocularis receptor type tyrosine protein phosphatase zeta 0.0028 0.0173 0.0175
Loa Loa (eye worm) CMGC/MAPK/ERK1 protein kinase 0.005 0.0373 0.0377
Onchocerca volvulus 0.0028 0.0173 0.5
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0028 0.0173 0.0175
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0028 0.0173 0.0175
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.0028 0.0173 0.0175
Trichomonas vaginalis CMGC family protein kinase 0.005 0.0373 0.0204
Echinococcus granulosus Receptor type tyrosine protein phosphatase O 0.0028 0.0173 0.0175
Onchocerca volvulus 0.0028 0.0173 0.5
Onchocerca volvulus 0.0028 0.0173 0.5
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.0028 0.0173 0.0175
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.0028 0.0173 0.0175
Echinococcus granulosus mitogen activated protein kinase 0.005 0.0373 0.0377
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0173 0.0175
Loa Loa (eye worm) hypothetical protein 0.0028 0.0173 0.0175
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0173 0.0175
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.0028 0.0173 0.0175
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0173 0.0175
Onchocerca volvulus 0.0028 0.0173 0.5
Trypanosoma cruzi trans-sialidase, Group I, putative 0.0296 0.2628 1
Onchocerca volvulus 0.0028 0.0173 0.5
Brugia malayi protein-tyrosine phosphatase Lar-like precursor, putative 0.0028 0.0173 0.0175
Trypanosoma cruzi trans-sialidase, putative 0.0296 0.2628 1
Schistosoma mansoni protein-tyrosine phosphatase n9 0.0028 0.0173 0.0175
Schistosoma mansoni microtubule-associated protein tau 0.0672 0.606 0.6118
Loa Loa (eye worm) hypothetical protein 0.0028 0.0173 0.0175
Schistosoma mansoni receptor tyrosine phosphatase type r2a 0.0028 0.0173 0.0175
Leishmania major mitogen activated protein kinase 4, putative;with=GeneDB:LmxM19.1440 0.005 0.0373 1
Echinococcus granulosus tyrosine protein phosphatase non receptor type 0.0028 0.0173 0.0175
Brugia malayi hypothetical protein 0.0028 0.0173 0.0175
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.0028 0.0173 0.0175
Loa Loa (eye worm) hypothetical protein 0.0028 0.0173 0.0175
Schistosoma mansoni protein tyrosine phosphatase 0.0028 0.0173 0.0175
Entamoeba histolytica protein tyrosine phosphatase, putative 0.0028 0.0173 0.5
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0028 0.0173 0.0175
Loa Loa (eye worm) hypothetical protein 0.0028 0.0173 0.0175
Loa Loa (eye worm) hypothetical protein 0.0028 0.0173 0.0175
Trypanosoma cruzi trans-sialidase, Group I, putative 0.0296 0.2628 1
Trichomonas vaginalis conserved hypothetical protein 0.0686 0.6189 0.6121
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0028 0.0173 0.0175
Brugia malayi Protein-tyrosine phosphatase 0.0028 0.0173 0.0175
Loa Loa (eye worm) hypothetical protein 0.0028 0.0173 0.0175
Trypanosoma cruzi trans-sialidase, putative 0.0296 0.2628 0.9998
Brugia malayi Protein-tyrosine phosphatase 0.0028 0.0173 0.0175
Echinococcus multilocularis receptor type tyrosine protein phosphatase zeta 0.0028 0.0173 0.0175
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0028 0.0173 0.0175
Loa Loa (eye worm) hypothetical protein 0.0028 0.0173 0.0175
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0173 0.0175
Schistosoma mansoni protein tyrosine phosphatase n11 (shp2) 0.0028 0.0173 0.0175
Entamoeba histolytica Pten 3-phosphoinositide phosphatase, putative 0.0028 0.0173 0.5
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0173 0.0175
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0173 0.0175
Onchocerca volvulus 0.0028 0.0173 0.5
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.0028 0.0173 0.0175
Echinococcus multilocularis Receptor type tyrosine protein phosphatase O 0.0028 0.0173 0.0175
Schistosoma mansoni serine/threonine protein kinase 0.005 0.0373 0.0377
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0028 0.0173 0.0175
Loa Loa (eye worm) hypothetical protein 0.0028 0.0173 0.0175
Onchocerca volvulus 0.0028 0.0173 0.5
Onchocerca volvulus 0.0028 0.0173 0.5
Loa Loa (eye worm) fibronectin type III domain-containing protein 0.0028 0.0173 0.0175
Onchocerca volvulus 0.0028 0.0173 0.5
Schistosoma mansoni receptor tyrosine phosphatase type r2a 0.0028 0.0173 0.0175
Echinococcus multilocularis Receptor type tyrosine protein phosphatase O 0.0028 0.0173 0.0175
Echinococcus multilocularis receptor type tyrosine protein phosphatase H 0.0028 0.0173 0.0175
Echinococcus granulosus protein tyrosine phosphatase n9 0.0028 0.0173 0.0175
Loa Loa (eye worm) transcription factor SMAD2 0.0129 0.1095 0.1105
Loa Loa (eye worm) dual specificity protein phosphatase CDC14B 0.0028 0.0173 0.0175
Trypanosoma cruzi trans-sialidase, Group I, putative 0.0296 0.2628 1
Loa Loa (eye worm) protein-tyrosine phosphatase 0.1093 0.9906 1
Trypanosoma cruzi trans-sialidase, Group I, putative 0.0296 0.2628 1
Trichomonas vaginalis CMGC family protein kinase 0.005 0.0373 0.0204
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.0028 0.0173 0.0175
Echinococcus multilocularis receptor type tyrosine protein phosphatase protein tyrosine phosphatase receptor type 0.0028 0.0173 0.0175
Onchocerca volvulus 0.0028 0.0173 0.5
Loa Loa (eye worm) hypothetical protein 0.0028 0.0173 0.0175
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.005 0.0373 0.0816
Trypanosoma brucei trans-sialidase, putative 0.0296 0.2628 1
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0173 0.0175
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.0028 0.0173 0.0175
Loa Loa (eye worm) hypothetical protein 0.0028 0.0173 0.0175
Trypanosoma cruzi trans-sialidase, Group I, putative 0.0296 0.2628 1
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0173 0.0175
Onchocerca volvulus 0.0028 0.0173 0.5
Loa Loa (eye worm) hypothetical protein 0.0028 0.0173 0.0175
Trypanosoma cruzi mitogen activated protein kinase 4, putative 0.005 0.0373 0.0816
Echinococcus multilocularis protein tyrosine phosphatase n9 0.0028 0.0173 0.0175
Schistosoma mansoni pcd6 interacting protein-related 0.0028 0.0173 0.0175
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0173 0.0175
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0028 0.0173 0.0175
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0028 0.0173 0.0175
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0173 0.0175
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0173 0.0175
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.0028 0.0173 0.0175
Entamoeba histolytica protein tyrosine phosphatase, putative 0.0028 0.0173 0.5
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0173 0.0175
Trichomonas vaginalis Sialidase-1 precursor, putative 0.1103 1 1
Echinococcus granulosus tyrosine protein phosphatase non receptor type 0.0028 0.0173 0.0175
Echinococcus granulosus tyrosine protein phosphatase non receptor type 0.1093 0.9906 1
Leishmania major mitogen activated protein kinase, putative,map kinase, putative 0.005 0.0373 1
Onchocerca volvulus 0.0028 0.0173 0.5
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0173 0.0175
Echinococcus multilocularis mitogen activated protein kinase 0.005 0.0373 0.0377
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0173 0.0175
Trypanosoma cruzi trans-sialidase, putative 0.0296 0.2628 0.9998
Schistosoma mansoni receptor tyrosine phosphatase type r2a 0.0028 0.0173 0.0175
Echinococcus multilocularis microtubule associated protein 2 0.0672 0.606 0.6118
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0028 0.0173 0.0175
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0028 0.0173 0.0175
Schistosoma mansoni receptor protein tyrosine phosphatase 0.0028 0.0173 0.0175
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0173 0.0175
Trypanosoma cruzi trans-sialidase, Group I, putative 0.0296 0.2628 1
Brugia malayi hypothetical protein 0.0028 0.0173 0.0175
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.0028 0.0173 0.0175
Trypanosoma brucei trans-sialidase, putative 0.0296 0.2628 1
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0173 0.0175
Onchocerca volvulus 0.0028 0.0173 0.5
Echinococcus multilocularis receptor type tyrosine protein phosphatase F 0.0028 0.0173 0.0175
Trypanosoma cruzi trans-sialidase, Group I, putative 0.0296 0.2628 1
Loa Loa (eye worm) hypothetical protein 0.0028 0.0173 0.0175
Loa Loa (eye worm) hypothetical protein 0.0028 0.0173 0.0175
Onchocerca volvulus 0.0028 0.0173 0.5
Loa Loa (eye worm) hypothetical protein 0.0028 0.0173 0.0175
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0028 0.0173 0.0175
Trypanosoma brucei protein kinase, putative 0.005 0.0373 0.0816
Trypanosoma cruzi trans-sialidase, putative 0.0296 0.2628 0.9998
Toxoplasma gondii CMGC kinase, MAPK family (ERK) MAPK-1 0.005 0.0373 0.5
Loa Loa (eye worm) hypothetical protein 0.0028 0.0173 0.0175
Trichomonas vaginalis CMGC family protein kinase 0.005 0.0373 0.0204
Onchocerca volvulus 0.0028 0.0173 0.5
Echinococcus multilocularis tyrosine protein phosphatase non receptor type 0.0028 0.0173 0.0175
Echinococcus multilocularis tyrosine protein phosphatase non receptor type 0.0028 0.0173 0.0175
Brugia malayi Dual specificity protein phosphatase CDC14B 0.0028 0.0173 0.0175
Brugia malayi Protein-tyrosine phosphatase containing protein 0.1093 0.9906 1
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0028 0.0173 0.0175
Trypanosoma brucei trans-sialidase, putative 0.0296 0.2628 1
Trypanosoma brucei trans-sialidase, putative 0.0296 0.2628 1
Brugia malayi Protein-tyrosine phosphatase 1 0.0028 0.0173 0.0175
Trypanosoma cruzi trans-sialidase, putative 0.0296 0.2628 0.9998
Trypanosoma cruzi trans-sialidase, Group I, putative 0.0296 0.2628 1
Echinococcus multilocularis Receptor type tyrosine protein phosphatase O 0.0028 0.0173 0.0175
Echinococcus multilocularis mitogen activated protein kinase 3 0.005 0.0373 0.0377
Loa Loa (eye worm) hypothetical protein 0.0028 0.0173 0.0175
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.0028 0.0173 0.0175
Echinococcus multilocularis tyrosine protein phosphatase non receptor type 0.0028 0.0173 0.0175
Schistosoma mansoni protein tyrosine phosphatase 0.0028 0.0173 0.0175
Brugia malayi hypothetical protein 0.0028 0.0173 0.0175
Schistosoma mansoni receptor protein tyrosine phosphatase r (pcptp1) 0.0028 0.0173 0.0175
Loa Loa (eye worm) hypothetical protein 0.0028 0.0173 0.0175
Echinococcus granulosus tyrosine protein phosphatase non receptor type 0.0028 0.0173 0.0175
Onchocerca volvulus 0.0028 0.0173 0.5
Echinococcus granulosus receptor type tyrosine protein phosphatase zeta 0.0028 0.0173 0.0175
Echinococcus granulosus tyrosine protein phosphatase non receptor type 0.0028 0.0173 0.0175
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0028 0.0173 0.0175
Trichomonas vaginalis CMGC family protein kinase 0.005 0.0373 0.0204
Loa Loa (eye worm) protein-tyrosine phosphatase 0.0028 0.0173 0.0175
Schistosoma mansoni receptor protein tyrosine phosphatase n (ia2) 0.0028 0.0173 0.0175
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0173 0.0175
Trypanosoma cruzi trans-sialidase, Group I, putative 0.0296 0.2628 1
Echinococcus granulosus receptor type tyrosine protein phosphatase 0.0028 0.0173 0.0175
Loa Loa (eye worm) protein-tyrosine phosphatase 1 0.0028 0.0173 0.0175
Onchocerca volvulus 0.0028 0.0173 0.5
Trypanosoma cruzi mitogen-activated protein kinase 11, putative 0.005 0.0373 0.0816
Echinococcus granulosus microtubule associated protein 2 0.0672 0.606 0.6118
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0173 0.0175
Loa Loa (eye worm) hypothetical protein 0.0028 0.0173 0.0175
Onchocerca volvulus 0.0028 0.0173 0.5
Echinococcus granulosus receptor type tyrosine protein phosphatase zeta 0.0028 0.0173 0.0175
Trypanosoma cruzi trans-sialidase, putative 0.0296 0.2628 1
Schistosoma mansoni receptor tyrosine phosphatase type r2a 0.0028 0.0173 0.0175
Echinococcus multilocularis tyrosine protein phosphatase non receptor type 0.0028 0.0173 0.0175
Brugia malayi hypothetical protein 0.0028 0.0173 0.0175
Loa Loa (eye worm) hypothetical protein 0.0028 0.0173 0.0175
Trypanosoma brucei trans-sialidase, putative 0.0296 0.2628 1
Echinococcus granulosus Receptor type tyrosine protein phosphatase O 0.0028 0.0173 0.0175
Brugia malayi hypothetical protein 0.0028 0.0173 0.0175
Brugia malayi MH2 domain containing protein 0.0129 0.1095 0.1105
Echinococcus multilocularis tyrosine protein phosphatase non receptor type 0.1093 0.9906 1
Trypanosoma brucei trans-sialidase 0.0296 0.2628 1
Giardia lamblia Kinase, CMGC MAPK 0.005 0.0373 1
Brugia malayi MAP kinase sur-1 0.005 0.0373 0.0377
Loa Loa (eye worm) hypothetical protein 0.0028 0.0173 0.0175
Onchocerca volvulus 0.0028 0.0173 0.5
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0173 0.0175
Loa Loa (eye worm) hypothetical protein 0.0028 0.0173 0.0175
Echinococcus multilocularis receptor type tyrosine protein phosphatase 0.0028 0.0173 0.0175
Onchocerca volvulus 0.0028 0.0173 0.5
Brugia malayi Protein-tyrosine phosphatase containing protein 0.0028 0.0173 0.0175
Schistosoma mansoni protein-tyrosine phosphatase non-receptor type nt5 0.0028 0.0173 0.0175
Echinococcus granulosus mitogen activated protein kinase 3 0.005 0.0373 0.0377
Echinococcus multilocularis Receptor type tyrosine protein phosphatase O 0.0028 0.0173 0.0175
Schistosoma mansoni non-receptor protein-tyrosine phosphatase 0.0028 0.0173 0.0175
Schistosoma mansoni protein tyrosine phosphatase 0.0028 0.0173 0.0175
Schistosoma mansoni receptor protein tyrosine phosphatase n (ia2) 0.0028 0.0173 0.0175
Schistosoma mansoni rgs-gaip interacting protein gipc 0.0028 0.0173 0.0175
Schistosoma mansoni protein tyrosine phosphatase non-receptor type nt1 0.1093 0.9906 1
Echinococcus multilocularis hypothetical protein 0.0028 0.0173 0.0175
Trypanosoma cruzi trans-sialidase, putative 0.0296 0.2628 1

Activities

No activities found for this compound.

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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