Detailed information for compound 906760

Basic information

Technical information
  • TDR Targets ID: 906760
  • Name: (4Z)-4-[(4-methylsulfanylphenyl)methylidene]- 2-phenyl-1,3-oxazol-5-one
  • MW: 295.356 | Formula: C17H13NO2S
  • H donors: 0 H acceptors: 1 LogP: 4.07 Rotable bonds: 3
    Rule of 5 violations (Lipinski): 1
  • SMILES: CSc1ccc(cc1)C=C1N=C(OC1=O)c1ccccc1
  • InChi: 1S/C17H13NO2S/c1-21-14-9-7-12(8-10-14)11-15-17(19)20-16(18-15)13-5-3-2-4-6-13/h2-11H,1H3/b15-11-
  • InChiKey: PXCPXPCAXFUXPM-PTNGSMBKSA-N  

Network

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Synonyms

  • (4Z)-4-[(4-methylsulfanylphenyl)methylene]-2-phenyl-oxazol-5-one
  • (4Z)-4-[[4-(methylthio)phenyl]methylene]-2-phenyl-5-oxazolone
  • (4Z)-4-[4-(methylthio)benzylidene]-2-phenyl-oxazol-5-one
  • ZINC00100672

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
Echinococcus granulosus cathepsin L cysteine protease 0.0035 0.0554 0.0554
Echinococcus multilocularis cathepsin L cysteine protease 0.0059 0.1367 0.1367
Entamoeba histolytica cysteine protease, putative 0.0035 0.0554 0.4054
Echinococcus granulosus cathepsin L 0.0035 0.0554 0.0554
Brugia malayi Cathepsin L-like precursor 0.0059 0.1367 0.1367
Loa Loa (eye worm) Papain cysteine protease/cathepsin propeptide inhibitor-containing protein 0.0059 0.1367 0.1367
Leishmania major cathepsin L-like protease 0.0059 0.1367 0.3168
Leishmania major cysteine peptidase A (CPA) 0.0059 0.1367 0.3168
Entamoeba histolytica cysteine protease, putative 0.0035 0.0554 0.4054
Onchocerca volvulus Cathepsin L homolog 0.0059 0.1367 1
Entamoeba histolytica cysteine protease, putative 0.0035 0.0554 0.4054
Brugia malayi Cathepsin L-like precursor 0.0059 0.1367 0.1367
Brugia malayi Cathepsin L-like precursor 0.0042 0.0813 0.0813
Brugia malayi Fli-1 protein 0.0223 0.6912 0.6912
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0059 0.1367 0.3201
Entamoeba histolytica cysteine protease, putative 0.0035 0.0554 0.4054
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0059 0.1367 0.3201
Echinococcus granulosus cysteine protease 0.0035 0.0554 0.0554
Plasmodium vivax unspecified product 0.0035 0.0554 0.4054
Loa Loa (eye worm) hypothetical protein 0.0035 0.0566 0.0566
Echinococcus granulosus cathepsin L cysteine proteinase 0.0059 0.1367 0.1367
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.011 0.3093 0.3093
Trypanosoma cruzi cysteine protease, putative 0.0035 0.0554 0.0554
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0059 0.1367 0.4419
Trypanosoma cruzi cysteine proteinase, putative 0.0035 0.0554 0.0554
Entamoeba histolytica cysteine protease, putative 0.0035 0.0554 0.4054
Entamoeba histolytica cysteine protease, putative 0.0035 0.0554 0.4054
Loa Loa (eye worm) fli-1 protein 0.0223 0.6912 0.6912
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0059 0.1367 0.4419
Echinococcus multilocularis cathepsin L 0.0035 0.0554 0.0554
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0315 1 1
Loa Loa (eye worm) hypothetical protein 0.0042 0.0813 0.0813
Brugia malayi Cathepsin L-like precursor 0.0042 0.0813 0.0813
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.009 0.2405 0.2405
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.009 0.2405 0.2405
Loa Loa (eye worm) hypothetical protein 0.0035 0.0566 0.0566
Trypanosoma cruzi cysteine peptidase, putative 0.0059 0.1367 0.1367
Trichomonas vaginalis D-aminoacylase, putative 0.0035 0.0566 0.1831
Echinococcus multilocularis cysteine protease 0.0059 0.1367 0.1367
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0059 0.1367 0.4419
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0059 0.1367 0.4419
Onchocerca volvulus 0.0035 0.0566 0.4142
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0059 0.1367 0.4419
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0059 0.1367 0.4419
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0059 0.1367 0.4419
Loa Loa (eye worm) D-ets-4 DNA binding domain-containing protein 0.0074 0.1862 0.1862
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0059 0.1367 0.4419
Brugia malayi Cathepsin L-like precursor 0.0059 0.1367 0.1367
Mycobacterium ulcerans hypothetical protein 0.0035 0.0566 0.5
Trichomonas vaginalis Clan CA, family C1, cathepsin L or K-like cysteine peptidase 0.0059 0.1367 0.4419
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0225 0.695 1
Plasmodium falciparum cysteine proteinase falcipain 2b 0.0059 0.1367 1
Giardia lamblia Cathepsin B precursor 0.011 0.3093 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0059 0.1367 0.3201
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0042 0.0813 0.2627
Loa Loa (eye worm) hypothetical protein 0.0035 0.0566 0.0566
Loa Loa (eye worm) hypothetical protein 0.0035 0.0566 0.0566
Schistosoma mansoni hypothetical protein 0.0165 0.4951 0.4951
Entamoeba histolytica cysteine proteinase, putative 0.0035 0.0554 0.4054
Trichomonas vaginalis Clan CA, family C1, cathepsin B-like cysteine peptidase 0.011 0.3093 1
Leishmania major cathepsin L-like protease 0.0059 0.1367 0.3168
Loa Loa (eye worm) fibroinase 0.0059 0.1367 0.1367
Plasmodium falciparum cysteine proteinase falcipain 1 0.0035 0.0554 0.4054
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0315 1 1
Echinococcus granulosus cathepsin b 0.0315 1 1
Schistosoma mansoni cathepsin F (C01 family) 0.0059 0.1367 0.1367
Leishmania major cathepsin L-like protease 0.0059 0.1367 0.3168
Echinococcus granulosus cathepsin b 0.0315 1 1
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0035 0.0566 0.0566
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0035 0.0554 0.1791
Leishmania major cathepsin L-like protease 0.0059 0.1367 0.3168
Brugia malayi Papain family cysteine protease containing protein 0.0035 0.0554 0.0554
Trypanosoma brucei hypothetical protein, conserved 0.0035 0.0566 0.0048
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0035 0.0566 0.0566
Echinococcus granulosus cathepsin l cysteine peptidase 0.0059 0.1367 0.1367
Brugia malayi Cathepsin L-like cysteine proteinase 0.0042 0.0813 0.0813
Loa Loa (eye worm) ctsf protein 0.0059 0.1367 0.1367
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.009 0.2405 0.2405
Trypanosoma cruzi cysteine peptidase C (CPC), putative 0.011 0.3093 0.3093
Plasmodium falciparum cysteine proteinase falcipain 2a 0.0059 0.1367 1
Schistosoma mansoni SmCB2 peptidase (C01 family) 0.0315 1 1
Entamoeba histolytica cysteine protease, putative 0.0035 0.0554 0.4054
Entamoeba histolytica cysteine proteinase, putative 0.0059 0.1367 1
Plasmodium vivax vivapain-2 0.0059 0.1367 1
Trypanosoma cruzi cysteine peptidase, clan CA, family C1, cathepsin L-like, putative 0.0042 0.0813 0.0813
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.0566 0.0566
Loa Loa (eye worm) papain family cysteine protease containing protein 0.0059 0.1367 0.1367
Loa Loa (eye worm) hypothetical protein 0.0042 0.0813 0.0813
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.009 0.2405 0.2405
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0035 0.0566 0.0566
Echinococcus multilocularis cathepsin b 0.0315 1 1
Trypanosoma cruzi cruzipain precursor, putative 0.0059 0.1367 0.1367
Onchocerca volvulus 0.0059 0.1367 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0059 0.1367 0.4419
Mycobacterium leprae Probable lipase LipE 0.0035 0.0566 0.5
Echinococcus multilocularis geminin 0.0165 0.4951 0.4951
Trichomonas vaginalis D-aminoacylase, putative 0.0035 0.0566 0.1831
Schistosoma mansoni gabp alpha 0.0074 0.1862 0.1862
Plasmodium vivax vivapain-1 0.0035 0.0554 0.4054
Schistosoma mansoni cathepsin F (C01 family) 0.0059 0.1367 0.1367
Onchocerca volvulus 0.0059 0.1367 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0042 0.0813 0.2627
Brugia malayi Cathepsin L-like precursor 0.0059 0.1367 0.1367
Plasmodium vivax hypothetical protein, conserved 0.0035 0.0566 0.4142
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0059 0.1367 0.1367
Brugia malayi Cathepsin L-like precursor 0.0059 0.1367 0.1367
Trichomonas vaginalis D-aminoacylase, putative 0.0035 0.0566 0.1831
Entamoeba histolytica cysteine protease, putative 0.0035 0.0554 0.4054
Onchocerca volvulus 0.0059 0.1367 1
Loa Loa (eye worm) cysteine protease 0.0059 0.1367 0.1367
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0059 0.1367 0.4419
Onchocerca volvulus 0.0059 0.1367 1
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0035 0.0566 0.5
Onchocerca volvulus Cathepsin F homolog 0.0059 0.1367 1
Plasmodium falciparum cysteine proteinase falcipain 3 0.0059 0.1367 1
Loa Loa (eye worm) hypothetical protein 0.0063 0.1502 0.1502
Onchocerca volvulus 0.0059 0.1367 1
Mycobacterium leprae conserved hypothetical protein 0.0035 0.0566 0.5
Loa Loa (eye worm) hypothetical protein 0.0035 0.0566 0.0566
Echinococcus multilocularis cathepsin L cysteine protease 0.0059 0.1367 0.1367
Onchocerca volvulus 0.0059 0.1367 1
Trypanosoma cruzi cysteine peptidase, putative 0.0059 0.1367 0.1367
Leishmania major cathepsin L-like protease 0.0059 0.1367 0.3168
Entamoeba histolytica cysteine proteinase, putative 0.0035 0.0554 0.4054
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0059 0.1367 0.4419
Echinococcus multilocularis GA binding protein alpha chain 0.0074 0.1862 0.1862
Brugia malayi Ets-domain containing protein 0.0074 0.1862 0.1862
Entamoeba histolytica cysteine protease, putative 0.0035 0.0554 0.4054
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0059 0.1367 0.4419
Trypanosoma brucei cysteine peptidase C (CPC) 0.011 0.3093 1
Echinococcus multilocularis cathepsin l cysteine peptidase 0.0059 0.1367 0.1367
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0059 0.1367 0.3201
Loa Loa (eye worm) beta-lactamase 0.0035 0.0566 0.0566
Entamoeba histolytica cysteine protease, putative 0.0035 0.0554 0.4054
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.009 0.2405 0.2405
Trichomonas vaginalis penicillin-binding protein, putative 0.0035 0.0566 0.1831
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0059 0.1367 0.3201
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0059 0.1367 0.3201
Trichomonas vaginalis esterase, putative 0.0035 0.0566 0.1831
Leishmania major cathepsin L-like protease 0.0059 0.1367 0.3168
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.009 0.2405 0.2405
Loa Loa (eye worm) hypothetical protein 0.0059 0.1367 0.1367
Trypanosoma cruzi cysteine peptidase, putative 0.0059 0.1367 0.1367
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.009 0.2405 0.2405
Echinococcus multilocularis cysteine protease 0.0059 0.1367 0.1367
Onchocerca volvulus 0.0059 0.1367 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0059 0.1367 0.4419
Schistosoma mansoni ets-related 0.0223 0.6912 0.6912
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0059 0.1367 0.4419
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.009 0.2405 0.2405
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0035 0.0566 0.0566
Entamoeba histolytica cysteine protease, putative 0.0035 0.0554 0.4054
Plasmodium vivax vivapain-2 0.0059 0.1367 1
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0059 0.1367 0.3201
Toxoplasma gondii ABC1 family protein 0.0035 0.0566 0.1831
Onchocerca volvulus 0.0035 0.0566 0.4142
Toxoplasma gondii cathepsin CPL 0.0059 0.1367 0.4419
Brugia malayi Ets-domain containing protein 0.0074 0.1862 0.1862
Brugia malayi Papain family cysteine protease containing protein 0.0059 0.1367 0.1367
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0035 0.0554 0.0554
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0059 0.1367 0.3201
Brugia malayi beta-lactamase family protein 0.0035 0.0566 0.0566
Echinococcus granulosus geminin 0.0165 0.4951 0.4951
Echinococcus granulosus cathepsin l1 0.0059 0.1367 0.1367
Brugia malayi Papain family cysteine protease containing protein 0.0035 0.0554 0.0554
Entamoeba histolytica cysteine proteinase, putative 0.0035 0.0554 0.4054
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0059 0.1367 0.4419
Onchocerca volvulus 0.0035 0.0566 0.4142
Entamoeba histolytica cysteine proteinase, putative 0.0035 0.0554 0.4054
Entamoeba histolytica cysteine protease, putative 0.0035 0.0554 0.4054
Brugia malayi beta-lactamase 0.0035 0.0566 0.0566
Trypanosoma cruzi cysteine peptidase (N-terminal), putative 0.0035 0.0554 0.0554
Entamoeba histolytica cysteine proteinase, putative 0.0042 0.0813 0.5946
Loa Loa (eye worm) hypothetical protein 0.0315 1 1
Entamoeba histolytica cysteine protease, putative 0.0059 0.1367 1
Trypanosoma cruzi cysteine peptidase C (CPC), putative 0.0315 1 1
Trypanosoma cruzi cysteine peptidase, putative 0.0059 0.1367 0.1367
Toxoplasma gondii cathepsin B 0.011 0.3093 1
Onchocerca volvulus 0.0042 0.0813 0.5946
Trypanosoma cruzi cysteine proteinase, putative 0.0035 0.0554 0.0554
Leishmania major cathepsin L-like protease 0.0059 0.1367 0.3168
Echinococcus granulosus GA binding protein alpha chain 0.0074 0.1862 0.1862
Leishmania major cysteine peptidase C (CPC),CPC cysteine peptidase, Clan CA, family C1, Cathepsin B-like 0.011 0.3093 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0059 0.1367 0.4419
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0059 0.1367 0.4419
Brugia malayi cathepsin L-like precursor 0.0042 0.0813 0.0813
Entamoeba histolytica cysteine proteinase 2 0.0035 0.0554 0.4054
Leishmania major cathepsin L-like protease 0.0059 0.1367 0.3168
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0035 0.0554 0.0554
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0059 0.1367 0.3201
Trypanosoma cruzi cysteine peptidase, putative 0.0035 0.0554 0.0554
Echinococcus multilocularis beta LACTamase domain containing family member 0.0035 0.0566 0.0566
Schistosoma mansoni hypothetical protein 0.0165 0.4951 0.4951
Giardia lamblia Cathepsin B precursor 0.011 0.3093 1
Schistosoma mansoni cathepsin B-like peptidase (C01 family) 0.0315 1 1
Entamoeba histolytica cysteine proteinase 1, putative 0.0035 0.0554 0.4054
Entamoeba histolytica cysteine protease, putative 0.0035 0.0554 0.4054
Trypanosoma cruzi hypothetical protein, conserved 0.0035 0.0566 0.0566
Trichomonas vaginalis penicillin-binding protein, putative 0.0035 0.0566 0.1831
Echinococcus granulosus cathepsin l1 0.0042 0.0813 0.0813
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0059 0.1367 0.4419
Echinococcus multilocularis cathepsin b 0.0315 1 1
Onchocerca volvulus Cathepsin L homolog 0.0059 0.1367 1
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0059 0.1367 0.4419
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0035 0.0554 0.1791
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0059 0.1367 0.4419
Brugia malayi Cathepsin L-like precursor 0.0059 0.1367 0.1367
Entamoeba histolytica cysteine proteinase, putative 0.0059 0.1367 1
Brugia malayi beta-lactamase family protein 0.0035 0.0566 0.0566
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.009 0.2405 0.2405
Mycobacterium ulcerans esterase/lipase LipP 0.0035 0.0566 0.5
Giardia lamblia Cathepsin B precursor 0.011 0.3093 1
Mycobacterium ulcerans beta-lactamase 0.0035 0.0566 0.5
Echinococcus granulosus beta LACTamase domain containing family member 0.0035 0.0566 0.0566
Mycobacterium ulcerans lipase LipD 0.0035 0.0566 0.5
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0059 0.1367 0.4419
Loa Loa (eye worm) hypothetical protein 0.0035 0.0566 0.0566
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0059 0.1367 0.3201
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0059 0.1367 0.4419
Trichomonas vaginalis Clan CA, family C1, cathepsin L-like cysteine peptidase 0.0059 0.1367 0.4419
Trypanosoma brucei cysteine peptidase, Clan CA, family C1, Cathepsin L-like 0.0059 0.1367 0.3201
Loa Loa (eye worm) cathepsin B 0.011 0.3093 0.3093
Schistosoma mansoni cathepsin F (C01 family) 0.0042 0.0813 0.0813
Trichomonas vaginalis Clan CA, family C1, papain-like cysteine peptidase 0.0059 0.1367 0.4419
Loa Loa (eye worm) hypothetical protein 0.0042 0.0813 0.0813
Schistosoma mansoni SmCL2-like peptidase (C01 family) 0.0035 0.0554 0.0554
Plasmodium vivax vivapain-3 0.0035 0.0554 0.4054

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.
 
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External resources for this compound

Bibliographic References

No literature references available for this target.

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