Detailed information for compound 1789448

Basic information

Technical information
  • Name: Unnamed compound
  • MW: 546.975 | Formula: C27H29ClF6N2O
  • H donors: 2 H acceptors: 1 LogP: 6.95 Rotable bonds: 9
    Rule of 5 violations (Lipinski): 2
  • SMILES: Clc1ccc2c(c1)C(CC2)N[C@@H]1CC[C@](C1)(C(C)C)C(=O)NCc1cc(cc(c1)C(F)(F)F)C(F)(F)F
  • InChi: 1S/C27H29ClF6N2O/c1-15(2)25(8-7-21(13-25)36-23-6-4-17-3-5-20(28)12-22(17)23)24(37)35-14-16-9-18(26(29,30)31)11-19(10-16)27(32,33)34/h3,5,9-12,15,21,23,36H,4,6-8,13-14H2,1-2H3,(H,35,37)/t21-,23?,25+/m1/s1
  • InChiKey: WADKCQYSBYIOSO-KYPFDINASA-N  


Substructure search Similarity search

Network

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Synonyms

No synonyms found for this compound

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
Toxoplasma gondii ABC1 family protein 0.004 0.0136 0.0561
Leishmania major heat shock protein 83-1 0.0047 0.018 0.0302
Mycobacterium tuberculosis Two component sensor histidine kinase TrcS 0.0047 0.018 0.1063
Trichomonas vaginalis sensory transduction histidine kinase, putative 0.0047 0.018 0.4269
Trypanosoma brucei PAB1-binding protein , putative 0.003 0.0068 0.0092
Schistosoma mansoni rotamase 0.0039 0.0128 0.0109
Echinococcus granulosus DNA topoisomerase 2 alpha 0.0047 0.018 0.0161
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.012 0.0657 0.0639
Echinococcus multilocularis heat shock protein 0.0047 0.018 0.0161
Trichomonas vaginalis heat shock protein, putative 0.0047 0.018 0.4269
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.008 0.0397 0.0378
Echinococcus granulosus Alpha N acetylgalactosaminidase 0.012 0.0657 0.0639
Brugia malayi Probable DNA topoisomerase II 0.0047 0.018 0.0337
Trypanosoma brucei DNA topoisomerase ii 0.0047 0.018 0.0302
Mycobacterium ulcerans two component sensor histidine kinase TrcS 0.0047 0.018 1
Plasmodium vivax ataxin-2 like protein, putative 0.003 0.0068 0.3029
Trypanosoma brucei pyruvate dehydrogenase (lipoamide) kinase, putative 0.0294 0.179 0.3321
Plasmodium falciparum heat shock protein 90 0.0047 0.018 1
Trypanosoma cruzi PAB1-binding protein , putative 0.003 0.0068 0.0092
Trichomonas vaginalis sensory transduction histidine kinase bacterial, putative 0.0047 0.018 0.4269
Loa Loa (eye worm) hypothetical protein 0.008 0.0397 0.0708
Toxoplasma gondii melibiase subfamily protein 0.012 0.0657 0.3073
Leishmania major heat shock protein 83-1 0.0047 0.018 0.0302
Plasmodium vivax hypothetical protein, conserved 0.0047 0.018 1
Plasmodium falciparum DNA gyrase subunit B 0.0047 0.018 1
Trypanosoma brucei heat shock protein, putative 0.0047 0.018 0.0302
Toxoplasma gondii ATPase/histidine kinase/DNA gyrase B/HSP90 domain-containing protein 0.0047 0.018 0.0776
Trypanosoma cruzi DNA topoisomerase II, putative 0.0047 0.018 0.0302
Mycobacterium ulcerans DNA gyrase subunit B 0.0047 0.018 1
Entamoeba histolytica hypothetical protein 0.0084 0.0425 1
Mycobacterium tuberculosis Conserved protein 0.0047 0.018 0.1063
Schistosoma mansoni DNA topoisomerase II 0.0047 0.018 0.0161
Brugia malayi heat shock protein 90 0.0047 0.018 0.0337
Mycobacterium ulcerans lipase LipD 0.004 0.0136 0.7222
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0084 0.0425 0.0406
Trichomonas vaginalis D-aminoacylase, putative 0.004 0.0136 0.3083
Chlamydia trachomatis DNA gyrase subunit B 0.0047 0.018 0.5
Loa Loa (eye worm) endoplasmin 0.0047 0.018 0.0302
Mycobacterium tuberculosis Conserved protein 0.004 0.0136 0.0767
Leishmania major hypothetical protein, conserved 0.004 0.0136 0.0218
Mycobacterium tuberculosis Two component sensor histidine kinase DosT 0.0047 0.018 0.1063
Plasmodium falciparum ataxin-2 like protein, putative 0.003 0.0068 0.3029
Loa Loa (eye worm) hypothetical protein 0.003 0.0068 0.0092
Trichomonas vaginalis mismatch repair protein Mlh1C (mutL homolog) 0.0047 0.018 0.4269
Brugia malayi beta-lactamase 0.004 0.0136 0.0254
Leishmania major DNA topoisomerase ii 0.0047 0.018 0.0302
Mycobacterium ulcerans two component sensor kinase MprB 0.0047 0.018 1
Entamoeba histolytica heat shock protein 90, putative 0.0047 0.018 0.3976
Loa Loa (eye worm) hypothetical protein 0.004 0.0136 0.0218
Schistosoma mansoni heat shock protein 0.0047 0.018 0.0161
Mycobacterium tuberculosis Two component sensor kinase [second part] 0.0047 0.018 0.1063
Trypanosoma cruzi mitochondrial DNA topoisomerase II, putative 0.0047 0.018 0.0302
Schistosoma mansoni endoplasmin 0.0047 0.018 0.0161
Leishmania major heat shock protein 83-1 0.0047 0.018 0.0302
Mycobacterium tuberculosis Conserved protein 0.004 0.0136 0.0767
Trypanosoma cruzi DNA topoisomerase II, putative 0.0047 0.018 0.0302
Leishmania major heat shock protein 83-1 0.0047 0.018 0.0302
Entamoeba histolytica hypothetical protein 0.0084 0.0425 1
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.004 0.0136 0.0117
Toxoplasma gondii LsmAD domain-containing protein 0.003 0.0068 0.0235
Plasmodium falciparum DNA topoisomerase 2 0.0047 0.018 1
Chlamydia trachomatis DNA gyrase subunit B 0.0047 0.018 0.5
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.012 0.0657 0.0639
Wolbachia endosymbiont of Brugia malayi DNA gyrase, topoisomerase II, B subunit, GyrB 0.0047 0.018 1
Trypanosoma cruzi pyruvate dehydrogenase (lipoamide) kinase, putative 0.0294 0.179 0.3321
Trichomonas vaginalis receptor histidine kinase, putative 0.0047 0.018 0.4269
Loa Loa (eye worm) hypothetical protein 0.0047 0.018 0.0302
Mycobacterium tuberculosis Probable hydrolase 0.004 0.0136 0.0767
Loa Loa (eye worm) hypothetical protein 0.004 0.0136 0.0218
Toxoplasma gondii ATPase/histidine kinase/DNA gyrase B/HSP90 domain-containing protein 0.0047 0.018 0.0776
Trypanosoma brucei heat shock protein, putative 0.0047 0.018 0.0302
Onchocerca volvulus DNA topoisomerase 2 homolog 0.0047 0.018 1
Trichomonas vaginalis penicillin-binding protein, putative 0.004 0.0136 0.3083
Entamoeba histolytica DNA topoisomerase II, putative 0.0047 0.018 0.3976
Mycobacterium tuberculosis Probable conserved lipoprotein 0.004 0.0136 0.0767
Mycobacterium ulcerans two component sensor histidine kinase PrrB 0.0047 0.018 1
Trichomonas vaginalis penicillin-binding protein, putative 0.004 0.0136 0.3083
Mycobacterium tuberculosis Probable sensor protein KdpD 0.0047 0.018 0.1063
Schistosoma mansoni pyruvate dehydrogenase 0.084 0.5352 0.5343
Mycobacterium ulcerans beta-lactamase 0.004 0.0136 0.7222
Mycobacterium ulcerans two component system response phosphate sensor kinase, PhoR 0.0047 0.018 1
Trypanosoma brucei DNA topoisomerase II beta, putative 0.0047 0.018 0.0302
Trypanosoma brucei heat shock protein, putative 0.0047 0.018 0.0302
Loa Loa (eye worm) hypothetical protein 0.0047 0.018 0.0302
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.004 0.0136 0.0767
Wolbachia endosymbiont of Brugia malayi membrane associated signal transduction histidine kinase 0.0047 0.018 1
Brugia malayi DNA topoisomerase II, alpha isozyme 0.0047 0.018 0.0337
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.004 0.0136 0.0767
Leishmania major heat shock protein 83-1 0.0047 0.018 0.0302
Schistosoma mansoni pyruvate dehydrogenase 0.0794 0.5047 0.5037
Trypanosoma cruzi heat shock protein 85, putative 0.0047 0.018 0.0302
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0084 0.0425 0.0406
Giardia lamblia Pms1-like protein 0.0047 0.018 1
Trypanosoma cruzi hypothetical protein, conserved 0.004 0.0136 0.0218
Echinococcus multilocularis Pyruvate dehydrogenase (lipoamide) kinase 0.084 0.5352 0.5343
Leishmania major heat shock protein 83-1 0.0047 0.018 0.0302
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase 0.0038 0.0123 0.0193
Mycobacterium leprae TWO COMPONENT SENSOR HISTIDINE KINASE PRRB 0.0047 0.018 1
Onchocerca volvulus Putative DNA topoisomerase 2, mitochondrial 0.0047 0.018 1
Mycobacterium tuberculosis Two component sensor kinase MprB 0.0047 0.018 0.1063
Brugia malayi DNA gyrase/topoisomerase IV, A subunit family protein 0.0047 0.018 0.0337
Plasmodium falciparum ataxin-2 like protein, putative 0.003 0.0068 0.3029
Mycobacterium tuberculosis Conserved protein 0.004 0.0136 0.0767
Loa Loa (eye worm) hypothetical protein 0.004 0.0136 0.0218
Toxoplasma gondii heat shock protein HSP90 0.0047 0.018 0.0776
Mycobacterium ulcerans hypothetical protein 0.004 0.0136 0.7222
Leishmania major heat shock protein 83-1 0.0047 0.018 0.0302
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.012 0.0657 0.0639
Brugia malayi exodeoxyribonuclease III family protein 0.0022 0.0019 0.0036
Schistosoma mansoni pyruvate dehydrogenase 0.0794 0.5047 0.5037
Echinococcus multilocularis heat shock protein 90 0.0047 0.018 0.0161
Mycobacterium ulcerans two component sensory transduction histidine kinase MtrB 0.0047 0.018 1
Entamoeba histolytica peptidyl-prolyl cis-trans isomerase, putative 0.0038 0.0123 0.2545
Mycobacterium leprae Probable two component sensor kinase MprB 0.0047 0.018 1
Mycobacterium leprae PUTATIVE TWO COMPONENT SENSOR HISTIDINE KINASE SENX3 0.0047 0.018 1
Echinococcus granulosus heat shock protein 0.0047 0.018 0.0161
Trypanosoma cruzi developmentally regulated phosphoprotein, putative 0.084 0.5352 1
Trypanosoma brucei heat shock protein, putative 0.0047 0.018 0.0302
Leishmania major heat shock protein 83-1 0.0047 0.018 0.0302
Mycobacterium ulcerans sensor kinase from two component regulatory system 0.0047 0.018 1
Leishmania major heat shock protein 83-1 0.0047 0.018 0.0302
Mycobacterium tuberculosis Two component sensor histidine kinase PrrB 0.0047 0.018 0.1063
Plasmodium falciparum endoplasmin, putative 0.0047 0.018 1
Leishmania major heat shock protein 83-1 0.0047 0.018 0.0302
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.004 0.0136 0.7222
Loa Loa (eye worm) hypothetical protein 0.084 0.5352 1
Leishmania major heat shock protein 83-1 0.0047 0.018 0.0302
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0255 0.1536 1
Leishmania major heat shock protein 83-1 0.0047 0.018 0.0302
Schistosoma mansoni microtubule-associated protein tau 0.1554 1 1
Trypanosoma cruzi mitochondrial DNA topoisomerase II, putative 0.0047 0.018 0.0302
Leishmania major hypothetical protein, conserved 0.0047 0.018 0.0302
Plasmodium vivax hypothetical protein, conserved 0.004 0.0136 0.7222
Echinococcus multilocularis DNA topoisomerase 2 alpha 0.0047 0.018 0.0161
Trypanosoma brucei DNA topoisomerase II alpha, putative 0.0047 0.018 0.0302
Chlamydia trachomatis two component regulatory system sensor histidine kinase 0.0047 0.018 0.5
Loa Loa (eye worm) TOPoisomerase family member 0.0047 0.018 0.0302
Trichomonas vaginalis rotamase, putative 0.0038 0.0123 0.2733
Trypanosoma cruzi heat shock protein 90, putative 0.0047 0.018 0.0302
Leishmania major heat shock protein 83-1 0.0047 0.018 0.0302
Trypanosoma brucei Heat shock protein 83, putative 0.0047 0.018 0.0302
Trypanosoma cruzi Histidine kinase-, DNA gyrase B-, and HSP90-like ATPase, putative 0.0047 0.018 0.0302
Loa Loa (eye worm) hypothetical protein 0.004 0.0136 0.0218
Trypanosoma brucei heat shock protein 90, putative 0.0047 0.018 0.0302
Schistosoma mansoni hypothetical protein 0.0084 0.0425 0.0406
Plasmodium falciparum DNA topoisomerase VI, b subunit, putative 0.0047 0.018 1
Trypanosoma brucei hypothetical protein, conserved 0.004 0.0136 0.0218
Trypanosoma brucei Histidine kinase-, DNA gyrase B-, and HSP90-like ATPase, putative 0.0047 0.018 0.0302
Mycobacterium tuberculosis Probable esterase LipL 0.004 0.0136 0.0767
Mycobacterium tuberculosis Probable lipase LipD 0.004 0.0136 0.0767
Mycobacterium ulcerans two component sensor histidine kinase DevS 0.0047 0.018 1
Giardia lamblia Heat shock protein HSP 90-alpha 0.0047 0.018 1
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.004 0.0136 0.0117
Echinococcus multilocularis Pyruvate dehydrogenase (lipoamide) kinase 0.084 0.5352 0.5343
Trypanosoma cruzi heat shock protein 90, putative 0.0047 0.018 0.0302
Trypanosoma brucei heat shock protein, putative 0.0047 0.018 0.0302
Mycobacterium tuberculosis Probable two component sensor kinase 0.0047 0.018 0.1063
Echinococcus multilocularis beta LACTamase domain containing family member 0.004 0.0136 0.0117
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.012 0.0657 0.0639
Brugia malayi Endoplasmin precursor 0.0047 0.018 0.0337
Loa Loa (eye worm) heat shock protein 90 0.0047 0.018 0.0302
Trichomonas vaginalis D-aminoacylase, putative 0.004 0.0136 0.3083
Mycobacterium tuberculosis Possible two component sensor kinase 0.0047 0.018 0.1063
Treponema pallidum DNA gyrase, subunit B (gyrB) 0.0047 0.018 1
Schistosoma mansoni transcription factor LCR-F1 0.0084 0.0425 0.0406
Mycobacterium ulcerans two component regulator - sensor kinase 0.0047 0.018 1
Entamoeba histolytica hypothetical protein 0.0084 0.0425 1
Wolbachia endosymbiont of Brugia malayi signal transduction histidine kinase and receiver 0.0047 0.018 1
Echinococcus multilocularis expressed protein 0.0039 0.0128 0.0109
Trichomonas vaginalis esterase, putative 0.004 0.0136 0.3083
Trichomonas vaginalis receptor histidine kinase, putative 0.0047 0.018 0.4269
Toxoplasma gondii ATPase/histidine kinase/DNA gyrase B/HSP90 domain-containing protein 0.0341 0.2095 1
Brugia malayi hypothetical protein 0.0084 0.0425 0.0794
Trichomonas vaginalis sensory transduction histidine kinase bacterial, putative 0.0047 0.018 0.4269
Trichomonas vaginalis conserved hypothetical protein 0.0039 0.0128 0.2891
Trypanosoma cruzi hypothetical protein, conserved 0.004 0.0136 0.0218
Mycobacterium ulcerans two component system membrane associated sensor kinase 0.0047 0.018 1
Leishmania major mitochondrial DNA topoisomerase II 0.0047 0.018 0.0302
Mycobacterium tuberculosis Two component sensor histidine kinase DevS 0.0047 0.018 0.1063
Plasmodium vivax endoplasmin, putative 0.0047 0.018 1
Leishmania major heat shock protein 83-1 0.0047 0.018 0.0302
Trichomonas vaginalis D-aminoacylase, putative 0.004 0.0136 0.3083
Toxoplasma gondii heat shock protein 90, putative 0.0047 0.018 0.0776
Mycobacterium tuberculosis Possible two component sensor kinase TcrY 0.0047 0.018 0.1063
Onchocerca volvulus DNA topoisomerase 2 homolog 0.0047 0.018 1
Echinococcus granulosus expressed protein 0.0039 0.0128 0.0109
Brugia malayi beta-lactamase family protein 0.004 0.0136 0.0254
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.004 0.0136 0.0218
Brugia malayi Melibiase family protein 0.008 0.0397 0.0742
Trichomonas vaginalis two component sensor and regulator histidine kinase bacteria, putative 0.0047 0.018 0.4269
Trypanosoma cruzi PAB1-binding protein , putative 0.003 0.0068 0.0092
Leishmania major heat shock protein 83-1 0.0047 0.018 0.0302
Leishmania major pyruvate dehydrogenase (lipoamide) kinase, putative 0.0294 0.179 0.3321
Trypanosoma brucei developmentally regulated phosphoprotein 0.084 0.5352 1
Trypanosoma brucei heat shock protein, putative 0.0047 0.018 0.0302
Trypanosoma cruzi peptidyl-prolyl cis-trans isomerase 0.0038 0.0123 0.0193
Schistosoma mansoni endoplasmin 0.0047 0.018 0.0161
Echinococcus granulosus Pyruvate dehydrogenase lipoamide kinase 0.084 0.5352 0.5343
Echinococcus multilocularis microtubule associated protein 2 0.1554 1 1
Loa Loa (eye worm) hypothetical protein 0.004 0.0136 0.0218
Trypanosoma cruzi heat shock protein 85, putative 0.0047 0.018 0.0302
Leishmania major heat shock protein 83-1 0.0047 0.018 0.0302
Mycobacterium tuberculosis Possible two component system response sensor kinase membrane associated PhoR 0.0047 0.018 0.1063
Brugia malayi kinase, mitochondrial precursor 0.084 0.5352 1
Loa Loa (eye worm) beta-lactamase 0.004 0.0136 0.0218
Toxoplasma gondii peptidylprolyl isomerase 0.0038 0.0123 0.0497
Plasmodium vivax heat shock protein 86, putative 0.0047 0.018 1
Trypanosoma brucei heat shock protein 90, putative 0.0047 0.018 0.0302
Trichomonas vaginalis rotamase, putative 0.0039 0.0128 0.2891
Plasmodium vivax DNA topoisomerase II, putative 0.0047 0.018 1
Schistosoma mansoni alpha-galactosidase/alpha-n-acetylgalactosaminidase 0.008 0.0397 0.0378
Loa Loa (eye worm) Pin1-type peptidyl-prolyl cis-trans isomerase 0.0039 0.0128 0.0205
Echinococcus multilocularis Glycoside hydrolase, family 27 0.012 0.0657 0.0639
Trichomonas vaginalis heat shock protein, putative 0.0047 0.018 0.4269
Trichomonas vaginalis alpha-galactosidase/alpha-N-acetylgalactosaminidase, putative 0.008 0.0397 1
Mycobacterium tuberculosis DNA gyrase (subunit B) GyrB (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (type II DNA topoisomerase) 0.0047 0.018 0.1063
Plasmodium vivax DNA gyrase subunit B, putative 0.0047 0.018 1
Mycobacterium tuberculosis Two component sensory transduction histidine kinase MtrB 0.0047 0.018 0.1063
Echinococcus granulosus beta LACTamase domain containing family member 0.004 0.0136 0.0117
Loa Loa (eye worm) hypothetical protein 0.004 0.0136 0.0218
Trichomonas vaginalis sensor histidine kinase, putative 0.0047 0.018 0.4269
Trypanosoma brucei heat shock protein, putative 0.0047 0.018 0.0302
Mycobacterium leprae Probable two-component sensor kinase 0.0047 0.018 1
Leishmania major heat shock protein 83-1 0.0047 0.018 0.0302
Toxoplasma gondii DNA topoisomerase 2, putative 0.0047 0.018 0.0776
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.004 0.0136 0.0254
Leishmania major hypothetical protein, conserved 0.003 0.0068 0.0092
Trypanosoma brucei heat shock protein, putative 0.0047 0.018 0.0302
Leishmania major peptidyl-prolyl cis-trans isomerase/rotamase, putative,PPIase, putative 0.0038 0.0123 0.0193
Trichomonas vaginalis DNA topoisomerase II, putative 0.0047 0.018 0.4269
Mycobacterium ulcerans putative regultory protein 0.0047 0.018 1
Mycobacterium ulcerans two component sensor histidine kinase SenX3 0.0047 0.018 1
Echinococcus granulosus heat shock protein 90 0.0047 0.018 0.0161
Entamoeba histolytica heat shock protein 90, putative 0.0047 0.018 0.3976
Trypanosoma brucei peptidyl-prolyl cis-trans isomerase/rotamase, putative 0.0038 0.0123 0.0193
Leishmania major developmentally regulated phosphoprotein-like protein 0.084 0.5352 1
Toxoplasma gondii pyruvate dehydrogenase kinase, putative 0.0294 0.179 0.8532
Brugia malayi Pin1-type peptidyl-prolyl cis-trans isomerase, BmPin1 0.0039 0.0128 0.024
Treponema pallidum chemotaxis histidine kinase (cheA) 0.0047 0.018 1
Mycobacterium tuberculosis Probable lipase LipE 0.004 0.0136 0.0767
Trichomonas vaginalis endoplasmin, putative 0.0047 0.018 0.4269
Entamoeba histolytica hypothetical protein 0.0084 0.0425 1
Brugia malayi beta-lactamase family protein 0.004 0.0136 0.0254
Brugia malayi hypothetical protein 0.003 0.0068 0.0127
Echinococcus multilocularis Alpha N acetylgalactosaminidase 0.012 0.0657 0.0639
Trypanosoma cruzi Heat shock protein 83, putative 0.0047 0.018 0.0302
Schistosoma mansoni heat shock protein 0.0047 0.018 0.0161
Trypanosoma cruzi heat shock protein 85, putative 0.0047 0.018 0.0302
Mycobacterium ulcerans esterase/lipase LipP 0.004 0.0136 0.7222

Activities

Activity type Activity value Assay description Source Reference
Inhibition (binding) = 28 % Displacement of [125I]-CCL2 from human CCR2 receptor expressed in human U2OS cell membrane at 1 uM relative to control ChEMBL. 24028535

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

1 literature reference was collected for this gene.

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