Detailed information for compound 1625825

Basic information

Technical information
  • TDR Targets ID: 1625825
  • Name: N'-[5-[3-[4-[3-[2-(2-acetylhydrazinyl)-4-meth yl-1,3-thiazol-5-yl]-3-oxoprop-1-enyl]phenyl] prop-2-enoyl]-4-methyl-1,3-thiazol-2-yl]aceto hydrazide
  • MW: 524.615 | Formula: C24H24N6O4S2
  • H donors: 4 H acceptors: 6 LogP: 4.64 Rotable bonds: 12
    Rule of 5 violations (Lipinski): 2
  • SMILES: O=C(c1sc(nc1C)NNC(=O)C)/C=C/c1ccc(cc1)/C=C/C(=O)c1sc(nc1C)NNC(=O)C
  • InChi: 1S/C24H24N6O4S2/c1-13-21(35-23(25-13)29-27-15(3)31)19(33)11-9-17-5-7-18(8-6-17)10-12-20(34)22-14(2)26-24(36-22)30-28-16(4)32/h5-12H,1-4H3,(H,25,29)(H,26,30)(H,27,31)(H,28,32)/b11-9+,12-10+
  • InChiKey: DMQOJXCSTNAIFR-WGDLNXRISA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • N'-[5-[(E)-3-[4-[(E)-3-[2-(2-acetylhydrazinyl)-4-methyl-1,3-thiazol-5-yl]-3-oxoprop-1-enyl]phenyl]prop-2-enoyl]-4-methyl-1,3-thiazol-2-yl]acetohydrazide
  • N'-[5-[3-[4-[3-[2-(N'-acetylhydrazino)-4-methyl-thiazol-5-yl]-3-oxo-prop-1-enyl]phenyl]prop-2-enoyl]-4-methyl-thiazol-2-yl]acetohydrazide
  • N'-[5-[(E)-3-[4-[(E)-3-[2-(N'-acetylhydrazino)-4-methyl-thiazol-5-yl]-3-oxo-prop-1-enyl]phenyl]prop-2-enoyl]-4-methyl-thiazol-2-yl]acetohydrazide
  • N'-[5-[(E)-3-[4-[(E)-3-[2-(N'-acetylhydrazino)-4-methyl-5-thiazolyl]-3-oxoprop-1-enyl]phenyl]-1-oxoprop-2-enyl]-4-methyl-2-thiazolyl]acetohydrazide
  • N'-[5-[3-[4-[3-[2-(N'-acetylhydrazino)-4-methyl-5-thiazolyl]-3-oxoprop-1-enyl]phenyl]-1-oxoprop-2-enyl]-4-methyl-2-thiazolyl]acetohydrazide
  • N'-[5-[(E)-3-[4-[(E)-3-[2-(N'-acetylhydrazino)-4-methyl-thiazol-5-yl]-3-keto-prop-1-enyl]phenyl]acryloyl]-4-methyl-thiazol-2-yl]acetohydrazide
  • N'-[5-[3-[4-[3-[2-(N'-acetylhydrazino)-4-methyl-thiazol-5-yl]-3-keto-prop-1-enyl]phenyl]acryloyl]-4-methyl-thiazol-2-yl]acetohydrazide
  • N'-[5-[(E)-3-[4-[(E)-3-[2-(2-ethanoylhydrazinyl)-4-methyl-1,3-thiazol-5-yl]-3-oxo-prop-1-enyl]phenyl]prop-2-enoyl]-4-methyl-1,3-thiazol-2-yl]ethanehydrazide
  • N'-[5-[3-[4-[3-[2-(2-ethanoylhydrazinyl)-4-methyl-1,3-thiazol-5-yl]-3-oxo-prop-1-enyl]phenyl]prop-2-enoyl]-4-methyl-1,3-thiazol-2-yl]ethanehydrazide
  • AIDS137068
  • N'-(5-(3-(4-(3-(2-(2-Acetylhydrazino)-4-methyl-1,3-thiazol-5-yl)-3-oxo-1-propenyl)phenyl)acryloyl)-4-methyl-1,3-thiazol-2-yl)acetohydrazide
  • NSC640587
  • NCI60_013552
  • AIDS-137068

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
Trichomonas vaginalis sugar transporter, putative 0.0855 0.3965 0.5
Trichomonas vaginalis sugar transporter, putative 0.0855 0.3965 0.5
Trypanosoma brucei THT1 - hexose transporter, putative 0.0855 0.3965 0.5
Echinococcus multilocularis solute carrier family 22 0.0855 0.3965 1
Brugia malayi Major Facilitator Superfamily protein 0.0855 0.3965 1
Brugia malayi major facilitator superfamily protein 0.0855 0.3965 1
Loa Loa (eye worm) hypothetical protein 0.0855 0.3965 1
Onchocerca volvulus Putative transporter 0.0855 0.3965 0.5
Trichomonas vaginalis sugar transporter, putative 0.0855 0.3965 0.5
Schistosoma mansoni sugar transporter 0.0855 0.3965 0.5
Trichomonas vaginalis sugar transporter, putative 0.0855 0.3965 0.5
Onchocerca volvulus 0.0855 0.3965 0.5
Trichomonas vaginalis sugar transporter, putative 0.0855 0.3965 0.5
Trichomonas vaginalis sugar transport protein, putative 0.0855 0.3965 0.5
Schistosoma mansoni sugar transporter 0.0855 0.3965 0.5
Onchocerca volvulus 0.0855 0.3965 0.5
Brugia malayi hypothetical protein 0.0855 0.3965 1
Trichomonas vaginalis glucose transporter, putative 0.0855 0.3965 0.5
Trichomonas vaginalis sugar transporter, putative 0.0855 0.3965 0.5
Trypanosoma cruzi hexose transporter, putative 0.0855 0.3965 0.5
Trypanosoma cruzi hexose transporter, putative 0.0855 0.3965 0.5
Trichomonas vaginalis sugar transporter, putative 0.0855 0.3965 0.5
Leishmania major myo-inositol/proton symporter (MIT) 0.0855 0.3965 1
Trichomonas vaginalis sugar transporter, putative 0.0855 0.3965 0.5
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0855 0.3965 0.3965
Trichomonas vaginalis sugar transporter, putative 0.0855 0.3965 0.5
Echinococcus granulosus solute carrier family 22 0.0855 0.3965 0.3965
Trichomonas vaginalis conserved hypothetical protein 0.0855 0.3965 0.5
Mycobacterium tuberculosis Probable conserved integral membrane transport protein 0.0855 0.3965 0.5
Loa Loa (eye worm) hypothetical protein 0.0855 0.3965 1
Loa Loa (eye worm) hypothetical protein 0.0855 0.3965 1
Loa Loa (eye worm) major facilitator superfamily transporter 0.0855 0.3965 1
Trypanosoma brucei sugar transporter, putative 0.0855 0.3965 0.5
Toxoplasma gondii facilitative glucose transporter GT1 0.0855 0.3965 0.5
Trichomonas vaginalis sugar transporter, putative 0.0855 0.3965 0.5
Echinococcus granulosus Sugar transporter ERD6 protein 0.0855 0.3965 0.3965
Trichomonas vaginalis sugar transporter, putative 0.0855 0.3965 0.5
Loa Loa (eye worm) hypothetical protein 0.0855 0.3965 1
Trypanosoma brucei THT1 - hexose transporter, putative 0.0855 0.3965 0.5
Toxoplasma gondii transporter, major facilitator family protein 0.0855 0.3965 0.5
Onchocerca volvulus 0.0855 0.3965 0.5
Schistosoma mansoni glucose transport protein 0.0855 0.3965 0.5
Giardia lamblia Hexose transporter 0.0855 0.3965 0.5
Echinococcus multilocularis solute carrier family 22 0.0855 0.3965 1
Mycobacterium ulcerans integral membrane transport protein 0.0855 0.3965 0.5
Trypanosoma brucei glucose transporter, putative 0.0855 0.3965 0.5
Onchocerca volvulus 0.0855 0.3965 0.5
Onchocerca volvulus 0.0855 0.3965 0.5
Trichomonas vaginalis sugar transporter, putative 0.0855 0.3965 0.5
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0855 0.3965 0.3965
Leishmania major glucose transporter, lmgt2 0.0855 0.3965 1
Schistosoma mansoni nuclear transcription factor X-box binding 1 (nfx1) 0.0855 0.3965 0.5
Trichomonas vaginalis glucose transporter, putative 0.0855 0.3965 0.5
Echinococcus multilocularis solute carrier family 2, facilitated glucose 0.0855 0.3965 1
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0855 0.3965 0.3965
Brugia malayi Major Facilitator Superfamily protein 0.0855 0.3965 1
Onchocerca volvulus 0.0855 0.3965 0.5
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0855 0.3965 0.3965
Echinococcus granulosus solute carrier family 22 0.0855 0.3965 0.3965
Onchocerca volvulus 0.0855 0.3965 0.5
Loa Loa (eye worm) sugar transporter 0.0855 0.3965 1
Trichomonas vaginalis sugar transporter, putative 0.0855 0.3965 0.5
Trichomonas vaginalis sugar transporter, putative 0.0855 0.3965 0.5
Echinococcus granulosus solute carrier family 22 0.0855 0.3965 0.3965
Schistosoma mansoni glucose transporter 0.0855 0.3965 0.5
Brugia malayi hypothetical protein 0.0855 0.3965 1
Plasmodium vivax hexose transporter 0.0855 0.3965 0.5
Echinococcus granulosus synaptic vesicle 2 protein 0.0855 0.3965 0.3965
Loa Loa (eye worm) sugar transporter 0.0855 0.3965 1
Onchocerca volvulus 0.0855 0.3965 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0855 0.3965 0.5
Trypanosoma brucei glucose transporter 2A 0.0855 0.3965 0.5
Trichomonas vaginalis sugar transporter, putative 0.0855 0.3965 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0855 0.3965 0.5
Loa Loa (eye worm) hypothetical protein 0.0855 0.3965 1
Toxoplasma gondii sugar transporter ST3 0.0855 0.3965 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0855 0.3965 0.5
Brugia malayi Sugar transporter family protein 0.0855 0.3965 1
Leishmania major glucose transporter, lmgt1 0.0855 0.3965 1
Schistosoma mansoni glucose transport protein 0.0855 0.3965 0.5
Plasmodium falciparum major facilitator superfamily domain-containing protein, putative 0.0855 0.3965 0.5
Trypanosoma brucei glucose transporter, putative 0.0855 0.3965 0.5
Mycobacterium ulcerans fusion protein of transposase for IS2606 and sialic acid-transport integral membrane protein NanT 0.0855 0.3965 0.5
Trichomonas vaginalis sugar transporter, putative 0.0855 0.3965 0.5
Echinococcus granulosus solute carrier family 22 0.0855 0.3965 0.3965
Trypanosoma brucei glucose transporter, putative 0.0855 0.3965 0.5
Trichomonas vaginalis sugar transporter, putative 0.0855 0.3965 0.5
Onchocerca volvulus 0.0855 0.3965 0.5
Trypanosoma brucei glucose transporter, putative 0.0855 0.3965 0.5
Mycobacterium tuberculosis Probable dicarboxylic acid transport integral membrane protein KgtP (dicarboxylate transporter) 0.0855 0.3965 0.5
Trichomonas vaginalis sugar transporter, putative 0.0855 0.3965 0.5
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0855 0.3965 1
Onchocerca volvulus 0.0855 0.3965 0.5
Echinococcus multilocularis solute carrier family 22 0.0855 0.3965 1
Trypanosoma brucei THT1 - hexose transporter, putative 0.0855 0.3965 0.5
Trypanosoma brucei glucose transporter 1E 0.0855 0.3965 0.5
Leishmania major glucose transporter/membrane transporter D2, putative 0.0855 0.3965 1
Mycobacterium ulcerans sugar transporter 0.0855 0.3965 0.5
Brugia malayi hypothetical protein 0.0855 0.3965 1
Echinococcus multilocularis Sugar transporter ERD6 protein 0.0855 0.3965 1
Brugia malayi Major Facilitator Superfamily protein 0.0855 0.3965 1
Trichomonas vaginalis sugar transporter, putative 0.0855 0.3965 0.5
Schistosoma mansoni glucose transport protein 0.0855 0.3965 0.5
Trichomonas vaginalis sugar transporter, putative 0.0855 0.3965 0.5
Trichomonas vaginalis sugar transporter, putative 0.0855 0.3965 0.5
Trichomonas vaginalis sugar transporter, putative 0.0855 0.3965 0.5
Loa Loa (eye worm) hypothetical protein 0.0855 0.3965 1
Trichomonas vaginalis sugar transporter, putative 0.0855 0.3965 0.5
Loa Loa (eye worm) hypothetical protein 0.0855 0.3965 1
Trichomonas vaginalis conserved hypothetical protein 0.0855 0.3965 0.5
Trypanosoma cruzi hexose transporter 0.0855 0.3965 0.5
Trichomonas vaginalis sugar transporter, putative 0.0855 0.3965 0.5
Loa Loa (eye worm) hypothetical protein 0.0855 0.3965 1
Loa Loa (eye worm) hypothetical protein 0.0855 0.3965 1
Loa Loa (eye worm) hypothetical protein 0.0855 0.3965 1
Trypanosoma brucei myo-inositol/proton symporter (MIT) 0.0855 0.3965 0.5
Loa Loa (eye worm) hypothetical protein 0.0855 0.3965 1
Trichomonas vaginalis conserved hypothetical protein 0.0855 0.3965 0.5
Trichomonas vaginalis glucose transporter, putative 0.0855 0.3965 0.5
Trichomonas vaginalis sugar transporter, putative 0.0855 0.3965 0.5
Loa Loa (eye worm) hypothetical protein 0.0855 0.3965 1
Trypanosoma brucei glucose transporter, putative 0.0855 0.3965 0.5
Plasmodium vivax sugar transporter, putative 0.0855 0.3965 0.5
Trichomonas vaginalis sugar transporter, putative 0.0855 0.3965 0.5
Loa Loa (eye worm) major facilitator superfamily transporter 0.0855 0.3965 1
Onchocerca volvulus 0.0855 0.3965 0.5
Plasmodium falciparum hexose transporter 0.0855 0.3965 0.5
Loa Loa (eye worm) hypothetical protein 0.0855 0.3965 1
Trichomonas vaginalis sugar transporter, putative 0.0855 0.3965 0.5
Onchocerca volvulus 0.0855 0.3965 0.5
Brugia malayi Sugar transporter family protein 0.0855 0.3965 1
Trichomonas vaginalis sugar transporter, putative 0.0855 0.3965 0.5
Onchocerca volvulus 0.0855 0.3965 0.5
Trypanosoma cruzi hexose transporter, putative 0.0855 0.3965 0.5
Toxoplasma gondii sugar transporter ST1 0.0855 0.3965 0.5
Brugia malayi major facilitator superfamily protein 0.0855 0.3965 1
Mycobacterium ulcerans sugar-transport integral membrane protein SugI 0.0855 0.3965 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0855 0.3965 0.5
Toxoplasma gondii sugar transporter ST2 0.0855 0.3965 0.5
Trichomonas vaginalis sugar transporter, putative 0.0855 0.3965 0.5
Trichomonas vaginalis myo-inositol transporter, putative 0.0855 0.3965 0.5
Trichomonas vaginalis sugar transporter, putative 0.0855 0.3965 0.5
Trypanosoma cruzi glucose transporter, putative 0.0855 0.3965 0.5
Trichomonas vaginalis sugar transporter, putative 0.0855 0.3965 0.5
Echinococcus multilocularis synaptic vesicle 2 protein 0.0855 0.3965 1
Trichomonas vaginalis sugar transporter, putative 0.0855 0.3965 0.5
Trypanosoma brucei glucose transporter, putative 0.0855 0.3965 0.5
Trichomonas vaginalis sugar transporter, putative 0.0855 0.3965 0.5
Loa Loa (eye worm) hypothetical protein 0.0855 0.3965 1
Trypanosoma cruzi hexose transporter, putative 0.0855 0.3965 0.5
Leishmania major glucose transporter, lmgt3 0.0855 0.3965 1
Onchocerca volvulus 0.0855 0.3965 0.5
Echinococcus multilocularis solute carrier family 22 0.0855 0.3965 1
Loa Loa (eye worm) hypothetical protein 0.0855 0.3965 1
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0855 0.3965 1
Giardia lamblia Sugar-proton symporter 0.0855 0.3965 0.5
Schistosoma mansoni sugar transporter 0.0855 0.3965 0.5
Trypanosoma brucei glucose transporter, putative 0.0855 0.3965 0.5
Brugia malayi Sugar transporter family protein 0.0855 0.3965 1
Trichomonas vaginalis conserved hypothetical protein 0.0855 0.3965 0.5
Leishmania major hypothetical protein, conserved 0.0855 0.3965 1
Schistosoma mansoni sugar transporter 0.0855 0.3965 0.5
Trypanosoma brucei glucose transporter, putative 0.0855 0.3965 0.5
Trichomonas vaginalis sugar transporter, putative 0.0855 0.3965 0.5
Trichomonas vaginalis sugar transporter, putative 0.0855 0.3965 0.5
Trichomonas vaginalis sugar transporter, putative 0.0855 0.3965 0.5
Onchocerca volvulus 0.0855 0.3965 0.5
Schistosoma mansoni hypothetical protein 0.0855 0.3965 0.5
Trypanosoma cruzi sugar transporter, putative 0.0855 0.3965 0.5
Trichomonas vaginalis sugar transporter, putative 0.0855 0.3965 0.5
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0855 0.3965 1
Trichomonas vaginalis sugar transporter, putative 0.0855 0.3965 0.5
Onchocerca volvulus 0.0855 0.3965 0.5
Wolbachia endosymbiont of Brugia malayi major facilitator superfamily permease 0.0855 0.3965 0.5

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 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 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 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 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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