Detailed information for compound 1649630

Basic information

Technical information
  • TDR Targets ID: 1649630
  • Name: 4-[5-[4-(5-pyridin-4-ylfuran-2-yl)phenyl]fura n-2-yl]pyridine
  • MW: 364.396 | Formula: C24H16N2O2
  • H donors: 0 H acceptors: 2 LogP: 4.56 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: n1ccc(cc1)c1ccc(o1)c1ccc(cc1)c1ccc(o1)c1ccncc1
  • InChi: 1S/C24H16N2O2/c1-2-18(22-6-8-24(28-22)20-11-15-26-16-12-20)4-3-17(1)21-5-7-23(27-21)19-9-13-25-14-10-19/h1-16H
  • InChiKey: JEUTWEAYQYYYBF-UHFFFAOYSA-N  

Network

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Synonyms

  • 4-[5-[4-[5-(4-pyridyl)-2-furyl]phenyl]-2-furyl]pyridine
  • NSC710271
  • NCI60_038798

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 subfamily S1A unassigned peptidase (S01 family) 0.0551 0.0232 0.0232
Plasmodium falciparum cysteine repeat modular protein 1 0.1585 0.4584 0.5
Echinococcus multilocularis glycoprotein Antigen 5 0.0621 0.0528 0.1152
Echinococcus granulosus glycoprotein Antigen 5 0.0621 0.0528 0.1152
Echinococcus granulosus tissue type plasminogen activator 0.1585 0.4584 1
Echinococcus granulosus enteropeptidase 0.0621 0.0528 0.1152
Plasmodium vivax cysteine repeat modular protein 1, putative 0.1585 0.4584 0.5
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.2764 0.9541 0.9541
Schistosoma mansoni hypothetical protein 0.1585 0.4584 0.4584
Echinococcus granulosus Mastin 0.0621 0.0528 0.1152
Loa Loa (eye worm) hypothetical protein 0.1585 0.4584 0.4804
Echinococcus multilocularis enteropeptidase 0.0621 0.0528 0.1152
Loa Loa (eye worm) hypothetical protein 0.2764 0.9541 1
Leishmania major hypothetical protein, conserved 0.1585 0.4584 0.5
Onchocerca volvulus 0.2764 0.9541 1
Onchocerca volvulus 0.2268 0.7456 0.7814
Onchocerca volvulus 0.1585 0.4584 0.4804
Brugia malayi Kringle domain containing protein 0.1585 0.4584 0.4804
Mycobacterium ulcerans hypothetical protein 0.0496 0 0.5
Brugia malayi Trypsin family protein 0.2764 0.9541 1
Schistosoma mansoni subfamily S1A unassigned peptidase (S01 family) 0.0621 0.0528 0.0528
Loa Loa (eye worm) hypothetical protein 0.2764 0.9541 1
Echinococcus multilocularis Mastin 0.0621 0.0528 0.1152
Echinococcus multilocularis tissue type plasminogen activator 0.1585 0.4584 1
Trypanosoma cruzi hypothetical protein, conserved 0.1585 0.4584 0.5
Toxoplasma gondii kringle domain-containing protein 0.1585 0.4584 1
Loa Loa (eye worm) TK/ROR protein kinase 0.1585 0.4584 0.4804
Brugia malayi Protein kinase domain containing protein 0.1585 0.4584 0.4804

Activities

Activity type Activity value Assay description Source Reference
GI50 (functional) -4.879 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SK-MEL-5 Melanoma cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.825 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the DU-145 Prostate cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.776 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the MDA-N Breast cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.773 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the NCI-H23 Non-Small Cell Lung cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.733 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HL-60(TB) Leukemia cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.704 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the MALME-3M Melanoma cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.668 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the UO-31 Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.65 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SN12C Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.609 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the ACHN Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4.516 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HOP-92 Non-Small Cell Lung cell line. (Class of assay: confirmatory) 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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