Detailed information for compound 1105893

Basic information

Technical information
  • TDR Targets ID: 1105893
  • Name: 2-amino-6-(2-methylphenyl)-N-[(3-methylpyridi n-2-yl)methyl]pyrimidine-4-carboxamide
  • MW: 333.387 | Formula: C19H19N5O
  • H donors: 2 H acceptors: 4 LogP: 2.32 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: Nc1nc(cc(n1)c1ccccc1C)C(=O)NCc1ncccc1C
  • InChi: 1S/C19H19N5O/c1-12-6-3-4-8-14(12)15-10-16(24-19(20)23-15)18(25)22-11-17-13(2)7-5-9-21-17/h3-10H,11H2,1-2H3,(H,22,25)(H2,20,23,24)
  • InChiKey: VQJMRQUZONINAW-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 2-amino-6-(2-methylphenyl)-N-[(3-methyl-2-pyridyl)methyl]pyrimidine-4-carboxamide
  • 2-amino-6-(2-methylphenyl)-N-[(3-methyl-2-pyridyl)methyl]-4-pyrimidinecarboxamide

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens adenosine A1 receptor Starlite/ChEMBL References
Homo sapiens adenosine A2a receptor Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Brugia malayi hypothetical protein adenosine A1 receptor 326 aa 305 aa 21.0 %
Brugia malayi follicle stimulating hormone receptor adenosine A2a receptor 412 aa 336 aa 22.3 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Plasmodium falciparum GTP-binding nuclear protein RAN/TC4 0.0024 0.0135 0.0477
Echinococcus multilocularis transitional endoplasmic reticulum atpase 0.0105 0.1141 0.1141
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0233 0.272 1
Trichomonas vaginalis DNA polymerase eta, putative 0.002 0.0082 0.0276
Echinococcus granulosus importin subunit beta 1 0.0033 0.0241 0.0582
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0039 0.0319 0.0319
Schistosoma mansoni cell division control protein 48 aaa family protein 0.0105 0.1141 0.2752
Schistosoma mansoni hypothetical protein 0.0183 0.2104 0.5077
Entamoeba histolytica hypothetical protein 0.0039 0.0319 0.1129
Echinococcus granulosus pyruvate kinase 0.0019 0.0067 0.0161
Trichomonas vaginalis DNA polymerase IV / kappa, putative 0.002 0.0082 0.0276
Echinococcus granulosus pyruvate kinase 0.0036 0.0284 0.0685
Brugia malayi vesicle-fusing ATPase 0.015 0.1686 0.7131
Onchocerca volvulus Rap guanine nucleotide exchange factor 1 homolog 0.0204 0.2364 0.769
Brugia malayi N-terminal motif family protein 0.0204 0.2364 1
Echinococcus granulosus muscleblind protein 0.0153 0.1731 0.4177
Echinococcus multilocularis pyruvate kinase 0.0019 0.0067 0.0067
Entamoeba histolytica hypothetical protein 0.0039 0.0319 0.1129
Echinococcus multilocularis pyruvate kinase 0.0029 0.019 0.019
Schistosoma mansoni hypothetical protein 0.0349 0.4145 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0049 0.0444 0.1072
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0024 0.0135 0.0477
Leishmania major pyruvate kinase 0.0036 0.0284 0.1005
Schistosoma mansoni importin beta-1 0.0033 0.0241 0.0582
Trypanosoma cruzi katanin-like protein, putative 0.0013 0.0000015878 0.0000056174
Trypanosoma brucei unspecified product 0.0014 0.0006 0.0023
Toxoplasma gondii cell division protein CDC48CY 0.0255 0.2989 1
Schistosoma mansoni pyruvate kinase 0.0036 0.0284 0.0685
Chlamydia trachomatis pyruvate kinase 0.0036 0.0284 0.5
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0049 0.0444 0.1072
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0049 0.0444 0.0444
Schistosoma mansoni hypothetical protein 0.0039 0.0319 0.077
Echinococcus granulosus dna polymerase eta 0.002 0.0082 0.0199
Schistosoma mansoni transcription factor LCR-F1 0.0039 0.0319 0.077
Giardia lamblia Pyruvate kinase 0.0036 0.0284 0.1648
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0082 0.0292
Schistosoma mansoni pyruvate kinase 0.0019 0.0067 0.0161
Brugia malayi vps4b-prov protein 0.0013 0.0000015878 0.0000067166
Loa Loa (eye worm) pyruvate kinase 0.0036 0.0284 0.0685
Echinococcus multilocularis pyruvate kinase 0.0036 0.0284 0.0284
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0026 0.0165 0.0552
Echinococcus multilocularis pyruvate kinase 0.0019 0.0067 0.0067
Mycobacterium tuberculosis Probable lipase LipE 0.0037 0.0289 0.0783
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0039 0.0319 0.077
Trypanosoma brucei unspecified product 0.0014 0.0006 0.0023
Brugia malayi ATPase, AAA family protein 0.0013 0.0000015878 0.0000067166
Toxoplasma gondii cell division protein CDC48AP 0.0153 0.1724 0.5767
Loa Loa (eye worm) pyruvate kinase 0.0036 0.0284 0.0685
Loa Loa (eye worm) hypothetical protein 0.0037 0.0289 0.0697
Mycobacterium ulcerans lipase LipD 0.0037 0.0289 0.1259
Giardia lamblia AAA family ATPase 0.0153 0.1724 1
Schistosoma mansoni ran 0.0024 0.0135 0.0325
Loa Loa (eye worm) hypothetical protein 0.0037 0.0289 0.0697
Giardia lamblia Pyruvate kinase 0.0019 0.0067 0.0388
Echinococcus granulosus pyruvate kinase 0.0019 0.0067 0.0161
Toxoplasma gondii ABC1 family protein 0.0037 0.0289 0.0967
Trichomonas vaginalis penicillin-binding protein, putative 0.0037 0.0289 0.0967
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0082 0.0292
Loa Loa (eye worm) hypothetical protein 0.002 0.0082 0.0199
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0037 0.0289 0.0783
Loa Loa (eye worm) vesicle-fusing ATPase 0.015 0.1686 0.4067
Toxoplasma gondii pyruvate kinase PyKII 0.0019 0.0067 0.0223
Brugia malayi beta-lactamase family protein 0.0037 0.0289 0.1223
Entamoeba histolytica hypothetical protein 0.0039 0.0319 0.1129
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0082 0.0292
Onchocerca volvulus 0.0037 0.0289 0.0019
Loa Loa (eye worm) VCP protein 0.0105 0.1141 0.2752
Brugia malayi Muscleblind-like protein 0.0153 0.1731 0.7324
Trichomonas vaginalis spermatogenesis associated factor, putative 0.0255 0.2989 1
Loa Loa (eye worm) hypothetical protein 0.015 0.1686 0.4067
Echinococcus multilocularis snurportin 1 0.0349 0.4145 0.4145
Loa Loa (eye worm) hypothetical protein 0.0153 0.1731 0.4177
Echinococcus granulosus geminin 0.0183 0.2104 0.5077
Onchocerca volvulus 0.0037 0.0289 0.0019
Toxoplasma gondii GTP-binding nuclear protein ran/tc4 0.0024 0.0135 0.0451
Toxoplasma gondii transitional endoplasmic reticulum ATPase, putative 0.0153 0.1724 0.5767
Echinococcus multilocularis beta LACTamase domain containing family member 0.0037 0.0289 0.0289
Entamoeba histolytica hypothetical protein 0.0026 0.0165 0.0584
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0049 0.0444 0.1072
Brugia malayi Importin beta-1 subunit 0.0033 0.0241 0.1021
Trichomonas vaginalis esterase, putative 0.0037 0.0289 0.0967
Loa Loa (eye worm) ImpB/MucB/SamB family protein 0.002 0.0082 0.0199
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0082 0.0292
Entamoeba histolytica hypothetical protein 0.0039 0.0319 0.1129
Echinococcus granulosus snurportin 1 0.0349 0.4145 1
Plasmodium vivax GTP-binding nuclear protein RAN/TC4, putative 0.0024 0.0135 0.0246
Echinococcus multilocularis transitional endoplasmic reticulum atpase 0.0255 0.2989 0.2989
Loa Loa (eye worm) nucleolar RNA-associated protein alpha 0.0349 0.4145 1
Loa Loa (eye worm) pyruvate kinase-PB 0.0025 0.0149 0.0359
Trypanosoma cruzi DNA polymerase kappa, putative 0.002 0.0082 0.0292
Schistosoma mansoni cell division control protein 48 aaa family protein 0.0242 0.2826 0.6819
Trypanosoma cruzi katanin, putative 0.0013 0.0000015878 0.0000056174
Trypanosoma cruzi katanin, putative 0.0013 0.0000015878 0.0000056174
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0037 0.0289 0.1223
Echinococcus granulosus transitional endoplasmic reticulum atpase 0.0255 0.2989 0.721
Echinococcus granulosus pyruvate kinase 0.0036 0.0284 0.0685
Trypanosoma brucei pyruvate kinase 1, putative 0.0036 0.0284 0.1005
Leishmania major DNA polymerase kappa, putative 0.002 0.0082 0.0292
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0082 0.0292
Trypanosoma brucei DNA polymerase kappa, putative 0.0014 0.0006 0.0023
Trypanosoma cruzi vacuolar transport protein 4A, putative 0.0013 0.0000015878 0.0000056174
Loa Loa (eye worm) hypothetical protein 0.0037 0.0289 0.0697
Schistosoma mansoni hypothetical protein 0.0183 0.2104 0.5077
Echinococcus multilocularis terminal deoxycytidyl transferase rev1 0.002 0.0082 0.0082
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0082 0.0292
Trichomonas vaginalis 26S protease regulatory subunit S10b, putative 0.006 0.0583 0.195
Trypanosoma cruzi importin beta-1 subunit, putative 0.0026 0.0165 0.0584
Trichomonas vaginalis importin beta-1, putative 0.0026 0.0165 0.0552
Trypanosoma cruzi DNA polymerase kappa, putative 0.002 0.0082 0.0292
Echinococcus granulosus terminal deoxycytidyl transferase rev1 0.002 0.0082 0.0199
Leishmania major GTP-binding protein, putative 0.0024 0.0135 0.0477
Mycobacterium tuberculosis Conserved protein 0.0037 0.0289 0.0783
Trichomonas vaginalis pyruvate kinase, putative 0.0036 0.0284 0.095
Echinococcus multilocularis dna polymerase kappa 0.002 0.0082 0.0082
Schistosoma mansoni rab geranylgeranyl transferase alpha subunit 0.002 0.0082 0.0199
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0037 0.0289 0.0697
Brugia malayi RNA, U transporter 1 0.0093 0.0985 0.4168
Trypanosoma cruzi pyruvate kinase 2, putative 0.0036 0.0284 0.1005
Mycobacterium tuberculosis Probable lipase LipD 0.0037 0.0289 0.0783
Trichomonas vaginalis Importin beta-1 subunit, putative 0.0026 0.0165 0.0552
Loa Loa (eye worm) hypothetical protein 0.0204 0.2364 0.5703
Echinococcus granulosus GTP binding nuclear protein Ran 0.0024 0.0135 0.0325
Trypanosoma cruzi metalloprotease, putative 0.0013 0.0000015878 0.0000056174
Trypanosoma brucei Valosin-containing protein 0.0242 0.2826 1
Onchocerca volvulus Transitional endoplasmic reticulum ATPase homolog 0.0255 0.2989 1
Brugia malayi hypothetical protein 0.0171 0.1952 0.8258
Trypanosoma brucei DNA polymerase kappa, putative 0.0014 0.0006 0.0023
Plasmodium vivax pyruvate kinase, putative 0.0036 0.0284 0.0787
Trypanosoma cruzi DNA polymerase eta, putative 0.002 0.0082 0.0292
Trypanosoma cruzi katanin, putative 0.0013 0.0000015878 0.0000056174
Mycobacterium tuberculosis Probable pyruvate kinase PykA 0.0036 0.0284 0.0764
Plasmodium falciparum importin beta, putative 0.0033 0.0241 0.0854
Mycobacterium ulcerans pyruvate kinase 0.0036 0.0284 0.1228
Trypanosoma cruzi Valosin-containing protein, putative 0.0242 0.2826 1
Loa Loa (eye worm) beta-lactamase 0.0037 0.0289 0.0697
Trypanosoma brucei DNA polymerase IV, putative 0.002 0.0082 0.0292
Leishmania major DNA polymerase eta, putative 0.002 0.0082 0.0292
Trichomonas vaginalis D-aminoacylase, putative 0.0037 0.0289 0.0967
Mycobacterium tuberculosis Conserved protein 0.0037 0.0289 0.0783
Entamoeba histolytica pyruvate kinase, putative 0.0025 0.0149 0.0527
Onchocerca volvulus 0.0171 0.1952 0.6168
Toxoplasma gondii HEAT repeat-containing protein 0.0033 0.0241 0.0807
Giardia lamblia DINP protein human, muc B family 0.002 0.0082 0.0478
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0049 0.0444 0.0444
Brugia malayi beta-lactamase 0.0037 0.0289 0.1223
Echinococcus multilocularis pyruvate kinase 0.0036 0.0284 0.0284
Plasmodium falciparum pyruvate kinase 0.0036 0.0284 0.1005
Loa Loa (eye worm) hypothetical protein 0.0037 0.0289 0.0697
Echinococcus multilocularis muscleblind protein 1 0.0153 0.1731 0.1731
Echinococcus multilocularis importin subunit beta 1 0.0033 0.0241 0.0241
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0037 0.0289 0.1259
Mycobacterium tuberculosis Conserved protein 0.0037 0.0289 0.0783
Brugia malayi valosin containing protein 0.015 0.1686 0.7131
Mycobacterium ulcerans hypothetical protein 0.0037 0.0289 0.1259
Trypanosoma brucei GTP-binding nuclear protein rtb2, putative 0.0024 0.0135 0.0477
Entamoeba histolytica transitional endoplasmic reticulum ATPase, putative 0.0242 0.2826 1
Loa Loa (eye worm) pyruvate kinase 0.0036 0.0284 0.0685
Schistosoma mansoni ran 0.0024 0.0135 0.0325
Trypanosoma cruzi DNA polymerase kappa, putative 0.002 0.0082 0.0292
Trypanosoma brucei DNA polymerase kappa, putative 0.0014 0.0006 0.0023
Loa Loa (eye worm) hypothetical protein 0.0036 0.0284 0.0685
Mycobacterium tuberculosis Probable esterase LipL 0.0037 0.0289 0.0783
Plasmodium falciparum cell division cycle protein 48 homologue, putative 0.0242 0.2826 1
Mycobacterium ulcerans beta-lactamase 0.0037 0.0289 0.1259
Echinococcus multilocularis geminin 0.0183 0.2104 0.2104
Schistosoma mansoni terminal deoxycytidyl transferase 0.002 0.0082 0.0199
Trichomonas vaginalis penicillin-binding protein, putative 0.0037 0.0289 0.0967
Mycobacterium ulcerans ATPase 0.0153 0.1724 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0049 0.0444 0.1072
Leishmania major hypothetical protein, conserved 0.0037 0.0289 0.1022
Trypanosoma cruzi vacuolar protein sorting-associated protein 4, putative 0.0013 0.0000015878 0.0000056174
Mycobacterium tuberculosis Probable hydrolase 0.0037 0.0289 0.0783
Leishmania major Transitional endoplasmic reticulum ATPase, putative,valosin-containing protein homolog 0.0242 0.2826 1
Loa Loa (eye worm) GTP-binding nuclear protein RAN/TC4 0.0024 0.0135 0.0325
Trypanosoma cruzi hypothetical protein, conserved 0.0037 0.0289 0.1022
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0082 0.0292
Trypanosoma cruzi katanin, putative 0.0013 0.0000015878 0.0000056174
Trypanosoma cruzi GTP-binding nuclear protein rtb2, putative 0.0024 0.0135 0.0477
Brugia malayi ImpB/MucB/SamB family protein 0.002 0.0082 0.0349
Trypanosoma brucei DNA polymerase IV, putative 0.002 0.0082 0.0292
Trypanosoma brucei hypothetical protein, conserved 0.0037 0.0289 0.1022
Leishmania major pyruvate kinase 0.0036 0.0284 0.1005
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0049 0.0444 0.188
Echinococcus multilocularis GTP binding nuclear protein Ran 0.0024 0.0135 0.0135
Brugia malayi ImpB/MucB/SamB family protein 0.002 0.0082 0.0349
Trypanosoma cruzi DNA polymerase kappa, putative 0.002 0.0082 0.0292
Plasmodium vivax importin-beta 2, putative 0.0033 0.0241 0.0632
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0037 0.0289 0.0697
Trypanosoma cruzi vesicular transport protein (CDC48 homologue), putative 0.0013 0.0000015878 0.0000056174
Echinococcus multilocularis muscleblind protein 0.0153 0.1731 0.1731
Giardia lamblia GTP-binding nuclear protein RAN/TC4 0.0024 0.0135 0.0782
Leishmania major importin beta-1 subunit, putative 0.0026 0.0165 0.0584
Plasmodium vivax hypothetical protein, conserved 0.0037 0.0289 0.0805
Loa Loa (eye worm) ATPase 0.0013 0.0000015878 0.0000038304
Trypanosoma cruzi hypothetical protein, conserved 0.0037 0.0289 0.1022
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0082 0.0292
Loa Loa (eye worm) hypothetical protein 0.0037 0.0289 0.0697
Brugia malayi Pyruvate kinase, M2 isozyme 0.0036 0.0284 0.1201
Echinococcus granulosus dna polymerase kappa 0.002 0.0082 0.0199
Trypanosoma cruzi pyruvate kinase 2, putative 0.0036 0.0284 0.1005
Trichomonas vaginalis pyruvate kinase, putative 0.0036 0.0284 0.095
Brugia malayi hypothetical protein 0.0039 0.0319 0.1349
Mycobacterium ulcerans esterase/lipase LipP 0.0037 0.0289 0.1259
Brugia malayi GTP-binding nuclear protein RAN/TC4 0.0024 0.0135 0.057
Trypanosoma brucei importin beta-1 subunit, putative 0.0033 0.0241 0.0854
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0049 0.0444 0.1072
Trypanosoma brucei DNA polymerase eta, putative 0.002 0.0082 0.0292
Trichomonas vaginalis ran, putative 0.0024 0.0135 0.0451
Loa Loa (eye worm) hypothetical protein 0.0171 0.1952 0.471
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0082 0.0292
Brugia malayi beta-lactamase family protein 0.0037 0.0289 0.1223
Plasmodium vivax cell division cycle ATPase, putative 0.0092 0.0979 0.3304
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0037 0.0289 0.0783
Schistosoma mansoni pyruvate kinase 0.0036 0.0284 0.0685
Entamoeba histolytica cdc48-like protein, putative 0.0242 0.2826 1
Entamoeba histolytica Ran family GTPase 0.0024 0.0135 0.0477
Trichomonas vaginalis proteasome-activating nucleotidase, putative 0.006 0.0583 0.195
Trypanosoma brucei pyruvate kinase 1 0.0036 0.0284 0.1005
Echinococcus multilocularis pyruvate kinase 0.0019 0.0067 0.0067
Echinococcus granulosus pyruvate kinase 0.0019 0.0067 0.0161
Schistosoma mansoni DNA polymerase eta 0.002 0.0082 0.0199
Mycobacterium leprae conserved hypothetical protein 0.0037 0.0289 1
Schistosoma mansoni cell division control protein 48 aaa family protein 0.0255 0.2989 0.721
Plasmodium vivax cell division cycle protein 48 homologue, putative 0.0242 0.2826 1
Echinococcus multilocularis dna polymerase eta 0.002 0.0082 0.0082
Mycobacterium leprae Probable lipase LipE 0.0037 0.0289 1
Plasmodium falciparum pyruvate kinase 2 0.0019 0.0067 0.0236
Trypanosoma brucei DNA polymerase IV, putative 0.002 0.0082 0.0292
Loa Loa (eye worm) fidgetin protein 0.0013 0.0000015878 0.0000038304
Trichomonas vaginalis D-aminoacylase, putative 0.0037 0.0289 0.0967
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0049 0.0444 0.1072
Leishmania major DNA polymerase kappa, putative,DNA polymerase IV, putative 0.002 0.0082 0.0292
Brugia malayi transitional endoplasmic reticulum ATPase TER94, putative 0.0105 0.1141 0.4826
Toxoplasma gondii pyruvate kinase PyK1 0.0036 0.0284 0.095
Onchocerca volvulus 0.0037 0.0289 0.0019
Trypanosoma cruzi katanin, putative 0.0013 0.0000015878 0.0000056174
Loa Loa (eye worm) hypothetical protein 0.0153 0.1731 0.4177
Loa Loa (eye worm) hypothetical protein 0.0033 0.0241 0.0582
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0037 0.0289 0.0783
Entamoeba histolytica deoxycytidyl transferase, putative 0.002 0.0082 0.0292
Trypanosoma brucei unspecified product 0.002 0.0082 0.0292
Brugia malayi Pyruvate kinase, muscle isozyme 0.0036 0.0284 0.1201
Mycobacterium tuberculosis Putative conserved ATPase 0.0153 0.1724 0.6221
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0037 0.0289 0.0697
Trypanosoma brucei DNA polymerase kappa, putative 0.002 0.0082 0.0292
Loa Loa (eye worm) hypothetical protein 0.0025 0.0149 0.0359
Echinococcus granulosus beta LACTamase domain containing family member 0.0037 0.0289 0.0697
Trypanosoma brucei importin beta-1 subunit, putative 0.0033 0.0241 0.0854
Trichomonas vaginalis D-aminoacylase, putative 0.0037 0.0289 0.0967
Loa Loa (eye worm) hypothetical protein 0.0037 0.0289 0.0697

Activities

Activity type Activity value Assay description Source Reference
Ki (binding) = 28 nM Displacement of radioligand from human adenosine A2A receptor expressed in cells by topcount microplate scintillation counting ChEMBL. 19695884
Ki (binding) = 1208 nM Displacement of radioligand from human adenosine A1 receptor expressed in cells by topcount microplate scintillation counting ChEMBL. 19695884

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.

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