Detailed information for compound 982546

Basic information

Technical information
  • TDR Targets ID: 982546
  • Name: N-[(4-oxochromen-3-yl)methylideneamino]pyridi ne-3-carboxamide
  • MW: 293.277 | Formula: C16H11N3O3
  • H donors: 1 H acceptors: 3 LogP: 1.59 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(c1cccnc1)N/N=C/c1coc2c(c1=O)cccc2
  • InChi: 1S/C16H11N3O3/c20-15-12(10-22-14-6-2-1-5-13(14)15)9-18-19-16(21)11-4-3-7-17-8-11/h1-10H,(H,19,21)/b18-9+
  • InChiKey: DAVIKTBRCQWOGT-GIJQJNRQSA-N  


Substructure search Similarity search

Network

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Synonyms

  • N-[(4-oxochromen-3-yl)methyleneamino]pyridine-3-carboxamide
  • N-[(4-oxo-3-chromenyl)methyleneamino]-3-pyridinecarboxamide
  • N-[(4-ketochromen-3-yl)methyleneamino]nicotinamide
  • SR-01000638229-1

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 conserved hypothetical protein 0.0028 0.0285 0.0183
Echinococcus multilocularis snurportin 1 0.0314 0.5846 0.5846
Brugia malayi hypothetical protein 0.0155 0.2757 0.2757
Wolbachia endosymbiont of Brugia malayi peptide deformylase 0.0227 0.4141 0.5
Schistosoma mansoni aminopeptidase A (M01 family) 0.0055 0.0798 0.1365
Schistosoma mansoni zinc finger protein 0.002 0.0124 0.0213
Trypanosoma brucei Polypeptide deformylase 1 0.0086 0.1417 0.5067
Loa Loa (eye worm) hypothetical protein 0.0101 0.1695 0.1896
Onchocerca volvulus 0.0262 0.4831 0.4647
Trypanosoma cruzi metallo-peptidase, Clan MA(E) Family M1 0.0055 0.0798 0.2791
Brugia malayi Importin beta-1 subunit 0.0029 0.0308 0.0308
Schistosoma mansoni tar DNA-binding protein 0.0065 0.0993 0.1699
Trypanosoma brucei importin beta-1 subunit, putative 0.0029 0.0308 0.0989
Trypanosoma cruzi metallo-peptidase, clan MA(E), family M1, putative 0.0055 0.0798 0.2791
Loa Loa (eye worm) hypothetical protein 0.0055 0.0798 0.0893
Brugia malayi Peptidase family M1 containing protein 0.0155 0.2757 0.2757
Loa Loa (eye worm) hypothetical protein 0.0044 0.0582 0.0651
Leishmania major aminopeptidase, putative,metallo-peptidase, Clan MA(E), Family M1 0.0055 0.0798 0.2791
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.0032 0.0354 0.0354
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0155 0.2757 0.2757
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0155 0.2757 0.2757
Schistosoma mansoni tar DNA-binding protein 0.0065 0.0993 0.1699
Loa Loa (eye worm) TAR-binding protein 0.0065 0.0993 0.1111
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0155 0.2757 0.2757
Loa Loa (eye worm) hypothetical protein 0.0055 0.0798 0.0893
Trypanosoma brucei metallo-peptidase, Clan MA(E) Family M1 0.0155 0.2757 1
Trypanosoma brucei aminopeptidase, putative 0.0055 0.0798 0.2791
Brugia malayi TAR-binding protein 0.0065 0.0993 0.0993
Echinococcus granulosus aminopeptidase N 0.0528 1 1
Echinococcus granulosus chromobox protein 1 0.0071 0.1119 0.1119
Trichomonas vaginalis chromobox protein, putative 0.0071 0.1119 0.1984
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.0155 0.2757 0.5522
Trypanosoma cruzi polypeptide deformylase-like protein, putative 0.0086 0.1417 0.5067
Onchocerca volvulus 0.0155 0.2757 0.25
Schistosoma mansoni importin beta-1 0.0029 0.0308 0.0527
Trypanosoma cruzi Aminopeptidase M1, putative 0.0155 0.2757 1
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0314 0.5846 0.654
Loa Loa (eye worm) hypothetical protein 0.0042 0.0544 0.0609
Loa Loa (eye worm) hypothetical protein 0.0029 0.0308 0.0345
Loa Loa (eye worm) TATA binding protein associated factor 0.0055 0.0798 0.0893
Plasmodium vivax SET domain protein, putative 0.0033 0.0378 0.0182
Schistosoma mansoni chromobox protein 0.0071 0.1119 0.1914
Brugia malayi RNA binding protein 0.0065 0.0993 0.0993
Plasmodium vivax M1-family alanyl aminopeptidase, putative 0.0055 0.0798 0.1278
Brugia malayi Pre-SET motif family protein 0.023 0.4213 0.4213
Echinococcus granulosus histone lysine methyltransferase setb 0.005 0.0716 0.0716
Brugia malayi TATA binding protein associated factor 0.0055 0.0798 0.0798
Trypanosoma cruzi importin beta-1 subunit, putative 0.0024 0.02 0.059
Echinococcus granulosus snurportin 1 0.0314 0.5846 0.5846
Brugia malayi Bromodomain containing protein 0.0077 0.1224 0.1224
Loa Loa (eye worm) hypothetical protein 0.0473 0.8938 1
Echinococcus multilocularis aminopeptidase N 0.0528 1 1
Leishmania major importin beta-1 subunit, putative 0.0024 0.02 0.059
Schistosoma mansoni family M1 non-peptidase homologue (M01 family) 0.0101 0.1695 0.2899
Loa Loa (eye worm) hypothetical protein 0.0039 0.0497 0.0556
Brugia malayi hypothetical protein 0.0055 0.0798 0.0798
Onchocerca volvulus 0.0528 1 1
Echinococcus multilocularis chromobox protein 1 0.0071 0.1119 0.1119
Schistosoma mansoni tar DNA-binding protein 0.0065 0.0993 0.1699
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0061 0.0921 0.0921
Schistosoma mansoni chromobox protein 0.0071 0.1119 0.1914
Trichomonas vaginalis chromobox protein, putative 0.0043 0.057 0.0799
Brugia malayi Heterochromatin protein 1 0.0071 0.1119 0.1119
Loa Loa (eye worm) aminopeptidase N 0.0155 0.2757 0.3085
Leishmania major aminopeptidase-like protein,metallo-peptidase, Clan MA(E), Family M1 0.0155 0.2757 1
Schistosoma mansoni acetyl-CoA C-acetyltransferase 0.0023 0.0183 0.0313
Brugia malayi Pre-SET motif family protein 0.0033 0.0378 0.0378
Schistosoma mansoni leukotriene A4 hydrolase (M01 family) 0.0055 0.0798 0.1365
Schistosoma mansoni hypothetical protein 0.0016 0.0039 0.0067
Leishmania major puromycin-sensitive aminopeptidase-like protein,metallo-peptidase, Clan MA(E), Family M1 0.0055 0.0798 0.2791
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0033 0.0378 0.0646
Schistosoma mansoni hypothetical protein 0.0021 0.0145 0.0249
Trichomonas vaginalis conserved hypothetical protein 0.004 0.0511 0.0672
Loa Loa (eye worm) peptidase family M1 containing protein 0.0427 0.8041 0.8997
Loa Loa (eye worm) PHD-finger family protein 0.0021 0.0145 0.0163
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.0155 0.2757 0.5522
Toxoplasma gondii histone lysine methyltransferase SET/SUV39 0.0033 0.0378 0.0182
Brugia malayi PHD-finger family protein 0.0025 0.023 0.023
Schistosoma mansoni methyl-cpg binding protein mbd 0.0017 0.0074 0.0127
Schistosoma mansoni tar DNA-binding protein 0.0065 0.0993 0.1699
Loa Loa (eye worm) hypothetical protein 0.0101 0.1695 0.1896
Schistosoma mansoni aminopeptidase PILS (M01 family) 0.0155 0.2757 0.4717
Echinococcus granulosus tar DNA binding protein 0.0065 0.0993 0.0993
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.023 0.4213 0.4714
Chlamydia trachomatis peptide deformylase 0.0227 0.4141 0.5
Echinococcus multilocularis fetal alzheimer antigen, falz 0.0023 0.0183 0.0183
Echinococcus multilocularis Peptidase M1, membrane alanine aminopeptidase, N terminal 0.0155 0.2757 0.2757
Echinococcus granulosus leukotriene A 4 hydrolase 0.0055 0.0798 0.0798
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0155 0.2757 0.2757
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0155 0.2757 0.2757
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0055 0.0798 0.0798
Loa Loa (eye worm) hypothetical protein 0.004 0.0511 0.0572
Leishmania major aminopeptidase, putative,metallo-peptidase, Clan MA(E), Family M1 0.0155 0.2757 1
Plasmodium falciparum M1-family alanyl aminopeptidase 0.0055 0.0798 0.1278
Toxoplasma gondii aminopeptidase N, putative 0.0055 0.0798 0.1278
Schistosoma mansoni cytosol alanyl aminopeptidase (M01 family) 0.0155 0.2757 0.4717
Loa Loa (eye worm) RNA binding protein 0.0065 0.0993 0.1111
Echinococcus multilocularis importin subunit beta 1 0.0029 0.0308 0.0308
Leishmania major polypeptide deformylase-like protein, putative 0.0086 0.1417 0.5067
Loa Loa (eye worm) hypothetical protein 0.0055 0.0798 0.0893
Trichomonas vaginalis Clan MA, family M1, aminopeptidase N-like metallopeptidase 0.0055 0.0798 0.1292
Plasmodium vivax M1-family alanyl aminopeptidase, putative 0.0055 0.0798 0.1278
Trichomonas vaginalis set domain proteins, putative 0.0262 0.4831 1
Trichomonas vaginalis conserved hypothetical protein 0.004 0.0511 0.0672
Echinococcus granulosus bromodomain adjacent to zinc finger domain 0.0037 0.0449 0.0449
Echinococcus granulosus zinc finger protein 0.002 0.0124 0.0124
Toxoplasma gondii aminopeptidase n, putative 0.0055 0.0798 0.1278
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0037 0.0449 0.0449
Schistosoma mansoni Tata binding protein associated factor (M01 family) 0.0055 0.0798 0.1365
Loa Loa (eye worm) leukotriene A4 hydrolase 0.0055 0.0798 0.0893
Trypanosoma cruzi aminopeptidase, putative 0.0055 0.0798 0.2791
Toxoplasma gondii aminopeptidase N protein 0.0055 0.0798 0.1278
Brugia malayi RNA recognition motif domain containing protein 0.0065 0.0993 0.0993
Echinococcus multilocularis zinc finger protein 0.002 0.0124 0.0124
Mycobacterium leprae PROBABLE POLYPEPTIDE DEFORMYLASE DEF (PDF) (FORMYLMETHIONINE DEFORMYLASE) 0.0227 0.4141 0.5
Brugia malayi Bromodomain containing protein 0.0039 0.0496 0.0496
Onchocerca volvulus 0.0055 0.0798 0.0471
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0155 0.2757 0.2757
Echinococcus multilocularis tar DNA binding protein 0.0065 0.0993 0.0993
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.005 0.0716 0.1226
Plasmodium falciparum peptide deformylase 0.0227 0.4141 1
Echinococcus multilocularis leukotriene A 4 hydrolase 0.0055 0.0798 0.0798
Echinococcus multilocularis bromodomain adjacent to zinc finger domain 0.0061 0.0921 0.0921
Echinococcus granulosus chromobox protein 1 0.0071 0.1119 0.1119
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0045 0.0604 0.1034
Onchocerca volvulus Heterochromatin protein 1 homolog 0.004 0.0511 0.0173
Toxoplasma gondii hypothetical protein 0.0227 0.4141 1
Trichomonas vaginalis chromobox protein, putative 0.0043 0.057 0.0799
Trypanosoma cruzi metallo-peptidase, Clan MA(E) Family M1 0.0101 0.1695 0.6091
Trypanosoma cruzi aminopeptidase, putative 0.0155 0.2757 1
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0155 0.2757 0.2757
Schistosoma mansoni bromodomain containing protein 0.0065 0.0992 0.1697
Mycobacterium tuberculosis Probable polypeptide deformylase Def (PDF) (formylmethionine deformylase) 0.0227 0.4141 0.5
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0155 0.2757 0.2757
Trypanosoma brucei Peptide deformylase 2 0.0086 0.1417 0.5067
Loa Loa (eye worm) hypothetical protein 0.005 0.0716 0.0802
Trypanosoma brucei importin beta-1 subunit, putative 0.0029 0.0308 0.0989
Trypanosoma brucei Aminopeptidase M1, putative 0.0155 0.2757 1
Loa Loa (eye worm) bromodomain containing protein 0.0018 0.0086 0.0097
Onchocerca volvulus 0.0045 0.0604 0.027
Mycobacterium ulcerans aminopeptidase N PepN 0.0155 0.2757 0.5861
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0065 0.0993 0.1111
Trichomonas vaginalis chromobox protein, putative 0.0071 0.1119 0.1984
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0055 0.0798 0.0798
Echinococcus multilocularis methyl CpG binding domain protein 2 0.0017 0.0074 0.0074
Trypanosoma cruzi polypeptide deformylase-like protein, putative 0.0086 0.1417 0.5067
Loa Loa (eye worm) hypothetical protein 0.0031 0.0343 0.0384
Echinococcus granulosus fetal alzheimer antigen falz 0.0023 0.0183 0.0183
Trypanosoma cruzi Peptide deformylase 2, putative 0.0086 0.1417 0.5067
Echinococcus granulosus puromycin sensitive aminopeptidase 0.0155 0.2757 0.2757
Trichomonas vaginalis conserved hypothetical protein 0.0028 0.0285 0.0183
Trypanosoma cruzi Peptide deformylase 2, putative 0.0086 0.1417 0.5067
Schistosoma mansoni zinc finger protein 0.0016 0.0039 0.0067
Entamoeba histolytica aminopeptidase, putative 0.0155 0.2757 1
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.005 0.0716 0.0716
Trypanosoma cruzi puromycin-sensitive aminopeptidase-like protein, putative 0.0055 0.0798 0.2791
Plasmodium vivax peptide deformylase, putative 0.0227 0.4141 1
Brugia malayi RNA, U transporter 1 0.0084 0.1363 0.1363
Loa Loa (eye worm) hypothetical protein 0.0372 0.6979 0.7808
Onchocerca volvulus Heterochromatin protein 1 homolog 0.0043 0.057 0.0234
Mycobacterium ulcerans peptide deformylase 0.0227 0.4141 1
Echinococcus multilocularis puromycin sensitive aminopeptidase 0.0101 0.1695 0.1695
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0033 0.0378 0.0378
Schistosoma mansoni hypothetical protein 0.0314 0.5846 1
Echinococcus multilocularis chromobox protein 1 0.0071 0.1119 0.1119
Schistosoma mansoni tar DNA-binding protein 0.0065 0.0993 0.1699
Brugia malayi chromobox protein homolog 3 0.004 0.0511 0.0511
Brugia malayi Peptidase family M1 containing protein 0.0055 0.0798 0.0798
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.005 0.0716 0.1226
Echinococcus granulosus methyl CpG binding domain protein 2 0.0017 0.0074 0.0074
Trypanosoma brucei Aminopeptidase M1, putative 0.0155 0.2757 1
Treponema pallidum polypeptide deformylase (def) 0.0227 0.4141 0.5
Loa Loa (eye worm) hypothetical protein 0.0072 0.1139 0.1275
Trypanosoma cruzi metallo-peptidase, clan MA(E), family M1, putative 0.0155 0.2757 1
Loa Loa (eye worm) heterochromatin protein 1 0.0071 0.1119 0.1252
Echinococcus granulosus importin subunit beta 1 0.0029 0.0308 0.0308
Trypanosoma cruzi puromycin-sensitive aminopeptidase-like protein, putative 0.0055 0.0798 0.2791
Plasmodium falciparum M1-family alanyl aminopeptidase, putative 0.0055 0.0798 0.1278
Schistosoma mansoni methyl-cpg binding protein mbd 0.0017 0.0074 0.0127

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) = 47 uM Inhibition of STAT5 (unknown origin) ChEMBL. No reference
IC50 (binding) = 130 uM Inhibition of STAT1 (unknown origin) ChEMBL. No reference
IC50 (binding) = 180 uM Inhibition of STAT3 (unknown origin) 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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