Detailed information for compound 1591858

Basic information

Technical information
  • TDR Targets ID: 1591858
  • Name: 2-hydrazinylidene-5-methyl-3-phenyl-4H-[1,3]t hiazolo[5,4-e]pyrimidin-7-one
  • MW: 273.314 | Formula: C12H11N5OS
  • H donors: 2 H acceptors: 1 LogP: 1.12 Rotable bonds: 1
    Rule of 5 violations (Lipinski): 1
  • SMILES: N/N=c/1\sc2c(n1c1ccccc1)nc([nH]c2=O)C
  • InChi: 1S/C12H11N5OS/c1-7-14-10-9(11(18)15-7)19-12(16-13)17(10)8-5-3-2-4-6-8/h2-6H,13H2,1H3,(H,14,15,18)/b16-12-
  • InChiKey: FDBVLTQSLHLNBZ-VBKFSLOCSA-N  


Substructure search Similarity search

Network

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Synonyms

  • (2Z)-2-hydrazinylidene-5-methyl-3-phenyl-4H-[1,3]thiazolo[5,4-e]pyrimidin-7-one
  • 2-hydrazono-5-methyl-3-phenyl-4H-thiazolo[5,4-e]pyrimidin-7-one
  • (2Z)-2-hydrazono-5-methyl-3-phenyl-4H-thiazolo[5,4-e]pyrimidin-7-one
  • 7-Hydroxy-5-methyl-3-phenyl[1,3]thiazolo[4,5-d]pyrimidin-2(3H)-one hydrazone
  • AIDS-140655
  • AIDS140655
  • NSC653411
  • NCI60_018638

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
Trypanosoma brucei glycosomal malate dehydrogenase 0.0078 0.185 0.7271
Trichomonas vaginalis malate dehydrogenase, putative 0.0086 0.2449 1
Brugia malayi Glycosyl hydrolases family 31 protein 0.0147 0.747 1
Leishmania major mitochondrial malate dehydrogenase 0.0078 0.185 0.6372
Brugia malayi Malate dehydrogenase, cytoplasmic 0.0086 0.2449 0.1065
Echinococcus multilocularis cytosolic malate dehydrogenase 0.0086 0.2449 0.1895
Echinococcus multilocularis lactate dehydrogenase protein 0.0089 0.2759 0.2228
Schistosoma mansoni hypothetical protein 0.0178 1 1
Schistosoma mansoni aldehyde dehydrogenase 0.0064 0.0683 0.0439
Schistosoma mansoni alpha-glucosidase 0.0147 0.747 0.7403
Trypanosoma cruzi glycosomal malate dehydrogenase, putative 0.0078 0.185 0.7271
Trichomonas vaginalis malate dehydrogenase, putative 0.0086 0.2449 1
Chlamydia trachomatis malate dehydrogenase 0.0086 0.2449 0.5
Schistosoma mansoni malate dehydrogenase 0.0089 0.2759 0.2569
Echinococcus granulosus lysosomal alpha glucosidase 0.0147 0.747 0.7284
Trypanosoma cruzi malate dehydrogenase, putative 0.0078 0.185 0.7271
Echinococcus multilocularis cytosolic malate dehydrogenase 0.0086 0.2449 0.1895
Leishmania major malate dehydrogenase 0.0078 0.185 0.6372
Echinococcus multilocularis geminin 0.0178 1 1
Leishmania major glycosomal malate dehydrogenase 0.0078 0.185 0.6372
Leishmania major cytosolic malate dehydrogenase 0.0086 0.2449 0.8763
Echinococcus granulosus cytosolic malate dehydrogenase 0.0086 0.2449 0.1895
Echinococcus granulosus lactate dehydrogenase protein 0.0089 0.2759 0.2228
Schistosoma mansoni aldehyde dehydrogenase 0.0064 0.0683 0.0439
Loa Loa (eye worm) malate dehydrogenase 0.0086 0.2449 0.1065
Trichomonas vaginalis malate dehydrogenase, putative 0.0059 0.0255 0.1043
Loa Loa (eye worm) glycosyl hydrolase family 31 protein 0.0147 0.747 1
Echinococcus granulosus L lactate dehydrogenase B chain 0.0089 0.2759 0.2228
Toxoplasma gondii lactate dehydrogenase LDH2 0.0089 0.2759 1
Echinococcus granulosus lactate dehydrogenase a 0.0089 0.2759 0.2228
Plasmodium vivax malate dehydrogenase, putative 0.0089 0.2759 1
Echinococcus multilocularis malate dehydrogenase 0.0078 0.185 0.1253
Mycobacterium leprae PROBABLE MALATE DEHYDROGENASE MDH 0.0086 0.2449 0.5
Entamoeba histolytica malate dehydrogenase, putative 0.0089 0.2759 1
Echinococcus multilocularis L lactate dehydrogenase B chain 0.0089 0.2759 0.2228
Echinococcus multilocularis lactate dehydrogenase a 0.0089 0.2759 0.2228
Trichomonas vaginalis malate dehydrogenase, putative 0.0086 0.2449 1
Schistosoma mansoni malate dehydrogenase 0.0086 0.2449 0.2251
Echinococcus granulosus cytosolic malate dehydrogenase 0.0086 0.2449 0.1895
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0064 0.0683 0.1708
Trypanosoma cruzi cytosolic malate dehydrogenase, putative 0.0086 0.2449 1
Trichomonas vaginalis malate and lactate dehydrogenase, putative 0.0086 0.2449 1
Brugia malayi lactate dehydrogenase. 0.0089 0.2759 0.1616
Trichomonas vaginalis malate and lactate dehydrogenase, putative 0.0086 0.2449 1
Echinococcus multilocularis lysosomal alpha glucosidase 0.0147 0.747 0.7284
Echinococcus multilocularis lysosomal alpha glucosidase 0.0147 0.747 0.7284
Echinococcus granulosus lactate dehydrogenase a 0.0089 0.2759 0.2228
Echinococcus multilocularis malate dehydrogenase 0.0078 0.185 0.1253
Echinococcus granulosus malate dehydrogenase 0.0078 0.185 0.1253
Toxoplasma gondii lactate dehydrogenase LDH1 0.0089 0.2759 1
Trichomonas vaginalis malate dehydrogenase, putative 0.0086 0.2449 1
Loa Loa (eye worm) hypothetical protein 0.0089 0.2759 0.1616
Schistosoma mansoni hypothetical protein 0.0178 1 1
Leishmania major malate dehydrogenase, putative 0.0089 0.2759 1
Trypanosoma cruzi cytosolic malate dehydrogenase, putative 0.0086 0.2449 1
Giardia lamblia Malate dehydrogenase 0.0086 0.2449 0.5
Schistosoma mansoni L-lactate dehydrogenase 0.0089 0.2759 0.2569
Plasmodium vivax lactate dehydrogenase 0.0089 0.2759 1
Trichomonas vaginalis malate dehydrogenase, putative 0.0086 0.2449 1
Trypanosoma cruzi glycosomal malate dehydrogenase, putative 0.0078 0.185 0.7271
Trichomonas vaginalis malate dehydrogenase, putative 0.0086 0.2449 1
Schistosoma mansoni malate dehydrogenase 0.0078 0.185 0.1637
Trichomonas vaginalis malate dehydrogenase, putative 0.0086 0.2449 1
Echinococcus granulosus malate dehydrogenase 0.0078 0.185 0.1253
Wolbachia endosymbiont of Brugia malayi malate dehydrogenase 0.0089 0.2759 0.5
Trichomonas vaginalis malate and lactate dehydrogenase, putative 0.0086 0.2449 1
Trichomonas vaginalis malate dehydrogenase, putative 0.0086 0.2449 1
Onchocerca volvulus 0.0099 0.3536 0.5
Toxoplasma gondii malate dehydrogenase MDH 0.0089 0.2759 1
Trypanosoma cruzi mitochondrial malate dehydrogenase, putative 0.0078 0.185 0.7271
Mycobacterium ulcerans malate dehydrogenase 0.0086 0.2449 1
Schistosoma mansoni malate dehydrogenase 0.0086 0.2449 0.2251
Trypanosoma brucei cytosolic malate dehydrogenase 0.0086 0.2449 1
Trichomonas vaginalis malate dehydrogenase, putative 0.0086 0.2449 1
Schistosoma mansoni alpha-glucosidase 0.0147 0.747 0.7403
Echinococcus multilocularis lactate dehydrogenase a 0.0089 0.2759 0.2228
Mycobacterium tuberculosis Probable malate dehydrogenase Mdh 0.0086 0.2449 1
Plasmodium falciparum L-lactate dehydrogenase 0.0089 0.2759 1
Plasmodium falciparum malate dehydrogenase 0.0089 0.2759 1
Trichomonas vaginalis malate dehydrogenase, putative 0.0086 0.2449 1
Echinococcus multilocularis lactate dehydrogenase a 0.0089 0.2759 0.2228
Trichomonas vaginalis malate and lactate dehydrogenase, putative 0.0086 0.2449 1
Trichomonas vaginalis malate dehydrogenase, putative 0.0086 0.2449 1
Trypanosoma brucei mitochondrial malate dehydrogenase 0.0078 0.185 0.7271

Activities

Activity type Activity value Assay description Source Reference
GI50 (functional) -4 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 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 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 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 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
GI50 (functional) -4 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 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SF-539 Central Nervous System cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4 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 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

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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