Detailed information for compound 694327

Basic information

Technical information
  • TDR Targets ID: 694327
  • Name: 5-[(3-fluorophenyl)-(4-methylpiperidin-1-yl)m ethyl]-2-furan-2-yl-[1,3]thiazolo[2,3-e][1,2, 4]triazol-6-ol
  • MW: 412.48 | Formula: C21H21FN4O2S
  • H donors: 1 H acceptors: 3 LogP: 4.54 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC1CCN(CC1)C(c1sc2n(c1O)nc(n2)c1ccco1)c1cccc(c1)F
  • InChi: 1S/C21H21FN4O2S/c1-13-7-9-25(10-8-13)17(14-4-2-5-15(22)12-14)18-20(27)26-21(29-18)23-19(24-26)16-6-3-11-28-16/h2-6,11-13,17,27H,7-10H2,1H3
  • InChiKey: BFQYEQXCUSBNPS-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 5-[(3-fluorophenyl)-(4-methyl-1-piperidyl)methyl]-2-(2-furyl)thiazolo[2,3-e][1,2,4]triazol-6-ol
  • 5-[(3-fluorophenyl)-(4-methyl-1-piperidinyl)methyl]-2-(2-furyl)-6-thiazolo[2,3-e][1,2,4]triazolol

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 multilocularis cyclins 0.0047 0.0148 0.0203
Echinococcus multilocularis Cyclin L1 0.0047 0.0148 0.0203
Schistosoma mansoni hypothetical protein 0.0047 0.0148 0.0203
Trichomonas vaginalis cyclin B, putative 0.0047 0.0148 0.1208
Trichomonas vaginalis cyclin B3, putative 0.0047 0.0148 0.1208
Trichomonas vaginalis cyclin D, putative 0.0047 0.0148 0.1208
Brugia malayi Cyclin, N-terminal domain containing protein 0.0047 0.0148 0.0222
Echinococcus multilocularis cyclin t1 0.0047 0.0148 0.0203
Trichomonas vaginalis set domain proteins, putative 0.0244 0.1226 1
Loa Loa (eye worm) transcription factor SMAD2 0.0122 0.0562 0.0562
Onchocerca volvulus 0.0052 0.0176 0.0405
Entamoeba histolytica cyclin, domain containing protein 0.0047 0.0148 1
Loa Loa (eye worm) MBCTL1 0.0059 0.0215 0.0215
Echinococcus multilocularis cyclin b3 0.0047 0.0148 0.0203
Loa Loa (eye worm) hypothetical protein 0.0096 0.0417 0.0417
Toxoplasma gondii hypothetical protein 0.0047 0.0148 0.0131
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0031 0.0061 0.0084
Brugia malayi Cyclin, N-terminal domain containing protein 0.0047 0.0148 0.0222
Schistosoma mansoni cyclin B 0.0047 0.0148 0.0203
Entamoeba histolytica cyclin C, putative 0.0047 0.0148 1
Trichomonas vaginalis cyclin A, putative 0.0047 0.0148 0.1208
Echinococcus granulosus tumor protein p63 0.0655 0.3471 0.4767
Entamoeba histolytica cyclin, domain containing protein 0.0047 0.0148 1
Brugia malayi Cyclin, N-terminal domain containing protein 0.0047 0.0148 0.0222
Trichomonas vaginalis cyclin D, putative 0.0047 0.0148 0.1208
Trypanosoma brucei mitotic cyclin 0.0047 0.0148 0.0222
Leishmania major inosine-5-monophosphate dehydrogenase 0.1241 0.6669 1
Loa Loa (eye worm) GMP reductase 0.0548 0.2887 0.2887
Plasmodium falciparum inosine-5'-monophosphate dehydrogenase 0.1241 0.6669 1
Brugia malayi inosine-5'-monophosphate dehydrogenase 0.0548 0.2887 0.4329
Echinococcus granulosus cyclin A3 4 0.0047 0.0148 0.0203
Schistosoma mansoni microtubule-associated protein tau 0.1353 0.7281 1
Brugia malayi Cyclin, N-terminal domain containing protein 0.0047 0.0148 0.0222
Trypanosoma brucei mitotic cyclin 6 0.0047 0.0148 0.0222
Echinococcus multilocularis cyclin B3 1 0.0047 0.0148 0.0203
Loa Loa (eye worm) cyclin C 0.0047 0.0148 0.0148
Leishmania major guanosine monophosphate reductase 0.1241 0.6669 1
Brugia malayi mbt repeat family protein 0.0052 0.0176 0.0264
Trichomonas vaginalis cyclin B, putative 0.0047 0.0148 0.1208
Mycobacterium leprae Probable inosine-5'-monophosphate dehydrogenase GuaB2 (IMP dehydrogenase) (IMPDH) (IMPD) 0.1241 0.6669 1
Echinococcus multilocularis cdk5 and abl1 enzyme substrate 1 0.0047 0.0148 0.0203
Brugia malayi inosine-5'-monophosphate dehydrogenase 0.0548 0.2887 0.4329
Echinococcus granulosus cdk5 and abl1 enzyme substrate 1 0.0047 0.0148 0.0203
Echinococcus granulosus 5'partial|histone lysine N methyltransferase SETDB2 0.003 0.0055 0.0076
Brugia malayi mbt repeat family protein 0.0052 0.0176 0.0264
Schistosoma mansoni cyclin B3 0.0047 0.0148 0.0203
Echinococcus granulosus cyclin G2 0.0047 0.0148 0.0203
Loa Loa (eye worm) cyclin domain-containing protein 0.0047 0.0148 0.0148
Schistosoma mansoni cyclins 0.0047 0.0148 0.0203
Mycobacterium ulcerans inosine 5'-monophosphate dehydrogenase 0.1241 0.6669 1
Echinococcus granulosus histone acetyltransferase MYST2 0.0059 0.0215 0.0295
Brugia malayi hypothetical protein 0.0047 0.0148 0.0222
Echinococcus granulosus cyclin y 0.0047 0.0148 0.0203
Onchocerca volvulus Cyclin L homolog 0.0047 0.0148 0.0306
Loa Loa (eye worm) MH2 domain-containing protein 0.0122 0.0562 0.0562
Trichomonas vaginalis cyclin A, putative 0.0047 0.0148 0.1208
Entamoeba histolytica cyclin family protein 0.0047 0.0148 1
Trypanosoma cruzi inosine-5'-monophosphate dehydrogenase, putative 0.1241 0.6669 1
Giardia lamblia Cyclin fold protein 1, putative 0.0047 0.0148 1
Echinococcus granulosus G2:mitotic specific cyclin B3 0.0047 0.0148 0.0203
Toxoplasma gondii IMP dehydrogenas 0.1241 0.6669 1
Leishmania major CYC2-like cyclin, putative,cyclin 6, putative 0.0047 0.0148 0.0222
Trichomonas vaginalis conserved hypothetical protein 0.0047 0.0148 0.1208
Onchocerca volvulus Cyclin L homolog 0.0047 0.0148 0.0306
Loa Loa (eye worm) IMP dehydrogenase 1 0.1241 0.6669 0.6669
Trichomonas vaginalis cyclin B3, putative 0.0047 0.0148 0.1208
Onchocerca volvulus Protein CNPPD1 homolog 0.0047 0.0148 0.0306
Loa Loa (eye worm) CYL-1 protein 0.0047 0.0148 0.0148
Schistosoma mansoni sex comb on midleg homolog 0.0052 0.0176 0.0241
Trichomonas vaginalis cyclins, putative 0.0047 0.0148 0.1208
Schistosoma mansoni cyclin G 0.0047 0.0148 0.0203
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0031 0.0061 0.0084
Schistosoma mansoni cellular tumor antigen P53 0.0096 0.0417 0.0573
Schistosoma mansoni cyclin l 0.0047 0.0148 0.0203
Trichomonas vaginalis cyclin D, putative 0.0047 0.0148 0.1208
Loa Loa (eye worm) hypothetical protein 0.0047 0.0148 0.0148
Echinococcus multilocularis SAM and MBT domain containing protein 0.0052 0.0176 0.0241
Echinococcus multilocularis cyclins 0.0047 0.0148 0.0203
Echinococcus granulosus cyclin y 0.0047 0.0148 0.0203
Loa Loa (eye worm) cyclin fold protein 1 variant b 0.0047 0.0148 0.0148
Echinococcus granulosus cyclin t1 0.0047 0.0148 0.0203
Trypanosoma brucei cyclin dependent kinase-binding protein, putative 0.0047 0.0148 0.0222
Brugia malayi GMP reductase 0.0548 0.2887 0.4329
Giardia lamblia Cyclin A 0.0047 0.0148 1
Echinococcus granulosus cyclin 0.0047 0.0148 0.0203
Onchocerca volvulus Putative GMP reductase 0.0548 0.2887 1
Plasmodium vivax inosine-5'-monophosphate dehydrogenase, putative 0.1241 0.6669 1
Echinococcus multilocularis microtubule associated protein 2 0.1353 0.7281 1
Echinococcus multilocularis cyclin G2 0.0047 0.0148 0.0203
Onchocerca volvulus 0.0244 0.1226 0.412
Echinococcus multilocularis cyclin y 0.0047 0.0148 0.0203
Brugia malayi hypothetical protein 0.0047 0.0148 0.0222
Echinococcus multilocularis polycomb protein SCMH1 0.0052 0.0176 0.0241
Plasmodium vivax cyclin homologue, putative 0.0047 0.0148 0.0131
Brugia malayi Cyclin, N-terminal domain containing protein 0.0047 0.0148 0.0222
Loa Loa (eye worm) follicle stimulating hormone receptor 0.0251 0.1264 0.1264
Echinococcus multilocularis cyclin B 0.0047 0.0148 0.0203
Loa Loa (eye worm) cyclin domain-containing protein 0.0047 0.0148 0.0148
Brugia malayi Cyclin, N-terminal domain containing protein 0.0047 0.0148 0.0222
Trichomonas vaginalis conserved hypothetical protein 0.0047 0.0148 0.1208
Echinococcus granulosus cyclin G2 0.0047 0.0148 0.0203
Entamoeba histolytica cyclin, putative 0.0047 0.0148 1
Trypanosoma cruzi cyclin, putative 0.0047 0.0148 0.0222
Echinococcus multilocularis G2:mitotic specific cyclin B3 0.0047 0.0148 0.0203
Echinococcus granulosus suppression of tumorigenicity 18 protein 0.0059 0.0215 0.0295
Trichomonas vaginalis cyclins, putative 0.0047 0.0148 0.1208
Echinococcus multilocularis G1:S specific cyclin D1 0.0047 0.0148 0.0203
Toxoplasma gondii cyclin domain protein, cyclin H family protein 0.0047 0.0148 0.0131
Trichomonas vaginalis cyclins, putative 0.0047 0.0148 0.1208
Onchocerca volvulus 0.0096 0.0417 0.1259
Mycobacterium leprae Probable inosine-5'-monophosphate dehydrogenase GuaB3 (IMP dehydrogenase 2) (inosinic acid dehydrogenase) (inosinate dehydrogena 0.0693 0.3676 0.2085
Echinococcus granulosus Cyclin L1 0.0047 0.0148 0.0203
Entamoeba histolytica cyclin family protein 0.0047 0.0148 1
Echinococcus multilocularis cyclin 0.0047 0.0148 0.0203
Brugia malayi Cyclin, N-terminal domain containing protein 0.0047 0.0148 0.0222
Mycobacterium ulcerans inosine 5-monophosphate dehydrogenase 0.0548 0.2887 0.4329
Brugia malayi Cyclin C 0.0047 0.0148 0.0222
Schistosoma mansoni cyclin G2 0.0047 0.0148 0.0203
Echinococcus granulosus cyclin B3 1 0.0047 0.0148 0.0203
Echinococcus granulosus polycomb protein SCMH1 0.0052 0.0176 0.0241
Trypanosoma cruzi cyclin, putative 0.0047 0.0148 0.0222
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0214 0.1064 0.1064
Mycobacterium ulcerans inosine 5-monophosphate dehydrogenase 0.1241 0.6669 1
Brugia malayi MH2 domain containing protein 0.0122 0.0562 0.0843
Echinococcus granulosus cyclins 0.0047 0.0148 0.0203
Entamoeba histolytica hypothetical protein 0.0047 0.0148 1
Trichomonas vaginalis conserved hypothetical protein 0.0047 0.0148 0.1208
Echinococcus multilocularis histone lysine N methyltransferase SETMAR 0.0031 0.0061 0.0084
Schistosoma mansoni histone-lysine n-methyltransferase setb1 0.0031 0.0061 0.0084
Schistosoma mansoni Cyclin fold protein 0.0047 0.0148 0.0203
Loa Loa (eye worm) hypothetical protein 0.0059 0.0215 0.0215
Trichomonas vaginalis cyclin B, putative 0.0047 0.0148 0.1208
Trypanosoma cruzi GMP reductase 0.1241 0.6669 1
Brugia malayi inosine-5'-monophosphate dehydrogenase family protein 0.1241 0.6669 1
Echinococcus multilocularis cyclins 0.0047 0.0148 0.0203
Trypanosoma cruzi hypothetical protein, conserved 0.0047 0.0148 0.0222
Echinococcus multilocularis inosine 5' monophosphate dehydrogenase 2 0.1241 0.6669 0.9159
Brugia malayi Pre-SET motif family protein 0.0031 0.0061 0.0092
Trypanosoma cruzi cyclin 9, putative 0.0047 0.0148 0.0222
Echinococcus multilocularis tumor protein p63 0.0655 0.3471 0.4767
Leishmania major mitotic cyclin, putative 0.0047 0.0148 0.0222
Echinococcus granulosus microtubule associated protein 2 0.1353 0.7281 1
Echinococcus multilocularis oligomeric golgi complex subunit 3 0.0047 0.0148 0.0203
Loa Loa (eye worm) hypothetical protein 0.0047 0.0148 0.0148
Trypanosoma cruzi cyclin 6, putative 0.0047 0.0148 0.0222
Onchocerca volvulus 0.0047 0.0148 0.0306
Schistosoma mansoni hypothetical protein 0.0047 0.0148 0.0203
Echinococcus granulosus cyclin k 0.0047 0.0148 0.0203
Schistosoma mansoni sex comb on midleg homolog 0.0052 0.0176 0.0241
Trichomonas vaginalis cyclins, putative 0.0047 0.0148 0.1208
Schistosoma mansoni cyclin k 0.0047 0.0148 0.0203
Loa Loa (eye worm) cyclin domain-containing protein 0.0047 0.0148 0.0148
Echinococcus multilocularis cyclins 0.0047 0.0148 0.0203
Schistosoma mansoni g1/s-specific cyclin C 0.0047 0.0148 0.0203
Echinococcus granulosus cyclins 0.0047 0.0148 0.0203
Toxoplasma gondii cyclin 4, putative 0.0047 0.0148 0.0131
Schistosoma mansoni scm-relatedprotein containing 4 mbt domains (sfmbt) 0.0052 0.0176 0.0241
Trypanosoma cruzi GMP reductase 0.1241 0.6669 1
Mycobacterium tuberculosis Probable inosine-5'-monophosphate dehydrogenase GuaB2 (imp dehydrogenase) (inosinic acid dehydrogenase) (inosinate dehydrogenase 0.1241 0.6669 1
Echinococcus granulosus oligomeric golgi complex subunit 3 0.0047 0.0148 0.0203
Onchocerca volvulus Polycomb protein Sfmbt homolog 0.0052 0.0176 0.0405
Toxoplasma gondii cyclin dependent kinase binding protein 0.0047 0.0148 0.0131
Trypanosoma cruzi inosine-5'-monophosphate dehydrogenase, putative 0.1241 0.6669 1
Trichomonas vaginalis cyclins, putative 0.0047 0.0148 0.1208
Trypanosoma brucei inosine-5'-monophosphate dehydrogenase 0.1241 0.6669 1
Echinococcus multilocularis cyclins 0.0047 0.0148 0.0203
Echinococcus granulosus histone lysine methyltransferase setb 0.0031 0.0061 0.0084
Trypanosoma cruzi inosine-5'-monophosphate dehydrogenase, putative 0.1241 0.6669 1
Echinococcus granulosus endonuclease exonuclease phosphatase 0.0204 0.1006 0.1381
Brugia malayi Pre-SET motif family protein 0.0214 0.1064 0.1595
Echinococcus multilocularis cyclin G2 0.0047 0.0148 0.0203
Loa Loa (eye worm) hypothetical protein 0.0047 0.0148 0.0148
Echinococcus multilocularis cyclins 0.0047 0.0148 0.0203
Schistosoma mansoni proteasome subunit alpha 1 (T01 family) 0.0047 0.0148 0.0203
Plasmodium vivax cyclin dependent kinase binding protein, putative 0.0047 0.0148 0.0131
Echinococcus granulosus cyclins 0.0047 0.0148 0.0203
Leishmania major cyclin 9, putative 0.0047 0.0148 0.0222
Brugia malayi Cyclin, N-terminal domain containing protein 0.0047 0.0148 0.0222
Loa Loa (eye worm) mbt repeat family protein 0.0052 0.0176 0.0176
Wolbachia endosymbiont of Brugia malayi IMP dehydrogenase 0.1241 0.6669 0.5
Toxoplasma gondii cyclin, N-terminal domain-containing protein 0.0047 0.0148 0.0131
Trichomonas vaginalis cyclins, putative 0.0047 0.0148 0.1208
Trichomonas vaginalis conserved hypothetical protein 0.0047 0.0148 0.1208
Loa Loa (eye worm) cyclin domain-containing protein 0.0047 0.0148 0.0148
Trichomonas vaginalis cyclins, putative 0.0047 0.0148 0.1208
Echinococcus multilocularis histone acetyltransferase MYST2 0.0059 0.0215 0.0295
Echinococcus multilocularis cyclin k 0.0047 0.0148 0.0203
Schistosoma mansoni myelin transcription factor 1 myt1 0.0059 0.0215 0.0295
Entamoeba histolytica cyclin, putative 0.0047 0.0148 1
Echinococcus multilocularis cyclin A3 4 0.0047 0.0148 0.0203
Brugia malayi cyclin fold protein 1 variant b 0.0047 0.0148 0.0222
Echinococcus multilocularis histone lysine methyltransferase setb histone lysine methyltransferase eggless 0.0031 0.0061 0.0084
Echinococcus multilocularis suppression of tumorigenicity 18 protein 0.0059 0.0215 0.0295
Loa Loa (eye worm) cyclin domain-containing protein 0.0047 0.0148 0.0148
Plasmodium vivax hypothetical protein, conserved 0.0047 0.0148 0.0131
Schistosoma mansoni cyclin d 0.0047 0.0148 0.0203
Schistosoma mansoni hypothetical protein 0.0314 0.1609 0.221
Schistosoma mansoni inosine-5-monophosphate dehydrogenase 0.1241 0.6669 0.9159
Loa Loa (eye worm) cyclin domain-containing protein 0.0047 0.0148 0.0148
Brugia malayi C2-HC type zinc finger protein C.e-MyT1 0.0059 0.0215 0.0322
Brugia malayi Cyclin, N-terminal domain containing protein 0.0047 0.0148 0.0222
Leishmania major cyclin 0.0047 0.0148 0.0222
Trichomonas vaginalis cyclin B, putative 0.0047 0.0148 0.1208
Trichomonas vaginalis cyclin B3, putative 0.0047 0.0148 0.1208
Echinococcus granulosus SAM and MBT domain containing protein 0.0052 0.0176 0.0241
Echinococcus granulosus G1:S specific cyclin D1 0.0047 0.0148 0.0203
Trichomonas vaginalis cyclin B, putative 0.0047 0.0148 0.1208
Trypanosoma cruzi mitotic cyclin, putative 0.0047 0.0148 0.0222
Giardia lamblia Cyclin B-like protein 0.0047 0.0148 1
Trypanosoma cruzi mitotic cyclin, putative 0.0047 0.0148 0.0222
Echinococcus multilocularis endonuclease exonuclease phosphatase 0.0204 0.1006 0.1381
Echinococcus granulosus cyclin B 0.0047 0.0148 0.0203
Echinococcus granulosus cyclins 0.0047 0.0148 0.0203
Echinococcus granulosus cyclin b3 0.0047 0.0148 0.0203
Onchocerca volvulus 0.0047 0.0148 0.0306
Trichomonas vaginalis conserved hypothetical protein 0.0047 0.0148 0.1208
Trypanosoma cruzi CYC2-like cyclin, putative 0.0047 0.0148 0.0222
Echinococcus granulosus cyclins 0.0047 0.0148 0.0203
Giardia lamblia G2/mitotic-specific cyclin B 0.0047 0.0148 1
Echinococcus granulosus inosine 5' monophosphate dehydrogenase 2 0.1241 0.6669 0.9159
Trichomonas vaginalis cyclins, putative 0.0047 0.0148 0.1208
Brugia malayi Cyclin, N-terminal domain containing protein 0.0047 0.0148 0.0222
Trypanosoma brucei cyclin 3 0.0047 0.0148 0.0222
Leishmania major mitotic cyclin, putative 0.0047 0.0148 0.0222
Loa Loa (eye worm) hypothetical protein 0.0052 0.0176 0.0176
Brugia malayi follicle stimulating hormone receptor 0.0251 0.1264 0.1895
Echinococcus granulosus cyclins 0.0047 0.0148 0.0203
Giardia lamblia Hypothetical protein 0.0047 0.0148 1
Trichomonas vaginalis cyclin B, putative 0.0047 0.0148 0.1208
Trypanosoma brucei cyclin 9 0.0047 0.0148 0.0222
Loa Loa (eye worm) hypothetical protein 0.0031 0.0061 0.0061
Trypanosoma brucei GMP reductase 0.1241 0.6669 1
Plasmodium vivax cyclin 4, putative 0.0047 0.0148 0.0131
Echinococcus multilocularis cyclins 0.0047 0.0148 0.0203
Mycobacterium tuberculosis Probable inosine-5'-monophosphate dehydrogenase GuaB3 (imp dehydrogenase) (inosinic acid dehydrogenase) (inosinate dehydrogenase 0.0693 0.3676 0.5511
Trichomonas vaginalis cyclin B, putative 0.0047 0.0148 0.1208
Loa Loa (eye worm) cyclin domain-containing protein 0.0047 0.0148 0.0148
Giardia lamblia Hypothetical protein 0.0047 0.0148 1
Giardia lamblia Hypothetical protein 0.0047 0.0148 1
Echinococcus multilocularis cyclin y 0.0047 0.0148 0.0203
Schistosoma mansoni histone-lysine n-methyltransferase suv9 0.0031 0.0061 0.0084

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.
 
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.

If you have references for this compound, please enter them in a user comment (below) or Contact us.