Detailed information for compound 285913

Basic information

Technical information
  • TDR Targets ID: 285913
  • Name: (2-amino-1-benzothiophen-3-yl)-naphthalen-1-y lmethanone
  • MW: 303.378 | Formula: C19H13NOS
  • H donors: 1 H acceptors: 1 LogP: 5.74 Rotable bonds: 2
    Rule of 5 violations (Lipinski): 1
  • SMILES: Nc1sc2c(c1C(=O)c1cccc3c1cccc3)cccc2
  • InChi: 1S/C19H13NOS/c20-19-17(15-9-3-4-11-16(15)22-19)18(21)14-10-5-7-12-6-1-2-8-13(12)14/h1-11H,20H2
  • InChiKey: QHNCOVLHDMVPLB-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • (2-aminobenzothiophen-3-yl)-(1-naphthyl)methanone
  • (2-amino-3-benzothiophenyl)-(1-naphthalenyl)methanone
  • (2-azanyl-1-benzothiophen-3-yl)-naphthalen-1-yl-methanone
  • (2-amino-3-benzothiophenyl)-(1-naphthyl)methanone
  • (2-amino-1-benzothiophen-3-yl)-naphthalen-1-yl-methanone

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 geminin 0.0182 0.0384 0.038
Echinococcus multilocularis glutamyl tRNA synthetase cytoplasmic 0.0033 0.0045 0.004
Toxoplasma gondii isocitrate dehydrogenase 0.0017 0.0008 0.0004
Leishmania major dihydrofolate reductase-thymidylate synthase 0.3326 0.7569 1
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 0.0034 0.0046 0.0042
Schistosoma mansoni protein kinase 0.0034 0.0046 0.0042
Mycobacterium ulcerans lysyl-tRNA synthetase 0.0025 0.0025 0.0021
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0111 0.0222 0.0217
Trypanosoma brucei bifunctional aminoacyl-tRNA synthetase, putative 0.0039 0.0057 0.007
Brugia malayi Bifunctional aminoacyl-tRNA synthetase 0.0033 0.0045 0.004
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0111 0.0222 0.0217
Plasmodium falciparum hexose transporter 0.0111 0.0222 0.0287
Echinococcus multilocularis isocitrate dehydrogenase 0.0017 0.0008 0.0003
Loa Loa (eye worm) ICD-1 protein 0.0037 0.0054 0.0054
Toxoplasma gondii lysine-tRNA ligase 0.0025 0.0025 0.0028
Echinococcus granulosus transcription factor btf3 0.0037 0.0054 0.005
Schistosoma mansoni transcription factor btf3 0.0037 0.0054 0.005
Loa Loa (eye worm) hypothetical protein 0.0033 0.0045 0.0045
Mycobacterium leprae DIHYDROFOLATE REDUCTASE DFRA (DHFR) (TETRAHYDROFOLATE DEHYDROGENASE) 0.439 1 1
Trichomonas vaginalis prolyl-tRNA synthetase, putative 0.0033 0.0045 0.0313
Loa Loa (eye worm) isocitrate dehydrogenase 0.0017 0.0008 0.0008
Schistosoma mansoni glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs) 0.0033 0.0045 0.004
Echinococcus multilocularis isocitrate dehydrogenase 2 (NADP+) 0.0017 0.0008 0.0003
Chlamydia trachomatis dihydrofolate reductase 0.439 1 1
Trypanosoma cruzi hexose transporter, putative 0.0019 0.0012 0.001
Plasmodium vivax basic transcription factor 3b, putative 0.0037 0.0054 0.0066
Trypanosoma cruzi isocitrate dehydrogenase, putative 0.0017 0.0008 0.0004
Plasmodium vivax mitogen-activated protein kinase 2, putative 0.0179 0.0377 0.0493
Echinococcus multilocularis thymidylate synthase 0.1218 0.2753 0.275
Toxoplasma gondii calcium-dependent protein kinase CDPK3 0.0034 0.0046 0.0055
Trichomonas vaginalis conserved hypothetical protein 0.0037 0.0054 0.0389
Leishmania major lysyl-tRNA synthetase, putative 0.0025 0.0025 0.0028
Plasmodium falciparum protein kinase 7 0.0313 0.0683 0.0897
Trypanosoma brucei glucose transporter, putative 0.0034 0.0047 0.0057
Trypanosoma brucei THT1 - hexose transporter, putative 0.0034 0.0047 0.0057
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0111 0.0222 0.0217
Loa Loa (eye worm) hypothetical protein 0.0016 0.0004 0.0004
Trypanosoma brucei glucose transporter, putative 0.0034 0.0047 0.0057
Brugia malayi isocitrate dehydrogenase 0.0017 0.0008 0.0003
Plasmodium falciparum bifunctional dihydrofolate reductase-thymidylate synthase 0.3326 0.7569 1
Plasmodium vivax calcium-dependent protein kinase 3, putative 0.0034 0.0046 0.0055
Leishmania major basic transcription factor 3a, putative 0.0037 0.0054 0.0066
Schistosoma mansoni glucose transport protein 0.0111 0.0222 0.0217
Toxoplasma gondii facilitative glucose transporter GT1 0.0111 0.0222 0.0287
Plasmodium falciparum calcium-dependent protein kinase 4 0.0034 0.0046 0.0055
Brugia malayi hypothetical protein 0.058 0.1293 0.129
Schistosoma mansoni serine/threonine protein kinase 0.0034 0.0046 0.0042
Trichomonas vaginalis conserved hypothetical protein 0.0034 0.0047 0.0332
Plasmodium falciparum proline--tRNA ligase 0.0039 0.0057 0.007
Plasmodium falciparum basic transcription factor 3b, putative 0.0037 0.0054 0.0066
Echinococcus granulosus glutamyl tRNA synthetase cytoplasmic 0.0033 0.0045 0.004
Leishmania major glucose transporter, lmgt2 0.0034 0.0047 0.0057
Schistosoma mansoni bifunctional dihydrofolate reductase-thymidylate synthase 0.1218 0.2753 0.275
Leishmania major isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0017 0.0008 0.0004
Trypanosoma cruzi hexose transporter, putative 0.0034 0.0047 0.0057
Toxoplasma gondii prolyl-tRNA synthetase (ProRS) 0.0039 0.0057 0.007
Echinococcus granulosus lysyl tRNA synthetase 0.0025 0.0025 0.0021
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0111 0.0222 0.0217
Trypanosoma cruzi hexose transporter, putative 0.0034 0.0047 0.0057
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0034 0.0046 0.0042
Brugia malayi Sugar transporter family protein 0.0111 0.0222 0.0217
Trypanosoma brucei glucose transporter, putative 0.0034 0.0047 0.0057
Trichomonas vaginalis sugar transporter, putative 0.0034 0.0047 0.0332
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0034 0.0046 0.0042
Schistosoma mansoni protein kinase 0.0034 0.0046 0.0042
Mycobacterium ulcerans lysyl-tRNA synthetase 0.0025 0.0025 0.0021
Plasmodium falciparum mitogen-activated protein kinase 2 0.0179 0.0377 0.0493
Loa Loa (eye worm) CAMK/CAMK2 protein kinase 0.0034 0.0046 0.0046
Schistosoma mansoni glucose transport protein 0.0111 0.0222 0.0217
Echinococcus granulosus NADP dependent isocitrate dehydrogenase 0.0017 0.0008 0.0003
Loa Loa (eye worm) hypothetical protein 0.0016 0.0004 0.0004
Wolbachia endosymbiont of Brugia malayi major facilitator superfamily permease 0.0016 0.0004 0.5
Loa Loa (eye worm) hypothetical protein 0.0016 0.0004 0.0004
Plasmodium falciparum calcium-dependent protein kinase 2 0.0034 0.0046 0.0055
Mycobacterium ulcerans dihydrofolate reductase DfrA 0.439 1 1
Loa Loa (eye worm) hypothetical protein 0.0016 0.0004 0.0004
Loa Loa (eye worm) hypothetical protein 0.0016 0.0004 0.0004
Loa Loa (eye worm) hypothetical protein 0.0016 0.0004 0.0004
Trypanosoma cruzi hexose transporter 0.0034 0.0047 0.0057
Leishmania major glucose transporter, lmgt3 0.0034 0.0047 0.0057
Entamoeba histolytica prolyl-tRNA synthetase, putative 0.0033 0.0045 0.6648
Loa Loa (eye worm) major facilitator superfamily transporter 0.0016 0.0004 0.0004
Trypanosoma brucei glucose transporter, putative 0.0034 0.0047 0.0057
Entamoeba histolytica transcription factor BTF3, putative 0.0037 0.0054 1
Mycobacterium leprae Possible lysyl-tRNA synthetase 2 LysX 0.0025 0.0025 0.0009
Trichomonas vaginalis conserved hypothetical protein 0.058 0.1293 1
Plasmodium vivax CDK-related protein kinase 6, putative 0.047 0.1042 0.1371
Loa Loa (eye worm) sugar transporter 0.0111 0.0222 0.0222
Plasmodium vivax calcium-dependent protein kinase 4, putative 0.0034 0.0046 0.0055
Loa Loa (eye worm) dihydrofolate reductase 0.439 1 1
Trichomonas vaginalis glucose transporter, putative 0.0034 0.0047 0.0332
Schistosoma mansoni hypothetical protein 0.0111 0.0222 0.0217
Mycobacterium tuberculosis Hypothetical protein 0.058 0.1293 0.129
Plasmodium vivax proline--tRNA ligase, putative 0.0039 0.0057 0.007
Trypanosoma brucei calcium/calmodulin-dependent protein kinase, putative 0.0034 0.0046 0.0055
Onchocerca volvulus 0.1218 0.2753 1
Leishmania major glucose transporter/membrane transporter D2, putative 0.0034 0.0047 0.0057
Trypanosoma cruzi lysyl-tRNA synthetase, putative 0.0025 0.0025 0.0028
Schistosoma mansoni glucose transport protein 0.0111 0.0222 0.0217
Trypanosoma cruzi transcription factor btf3, putative 0.0037 0.0054 0.0066
Trypanosoma brucei glucose transporter, putative 0.0034 0.0047 0.0057
Trypanosoma brucei transcription factor BTF3, putative 0.0037 0.0054 0.0066
Schistosoma mansoni lysyl-tRNA synthetase 0.0025 0.0025 0.0021
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0017 0.0008 0.0003
Echinococcus granulosus geminin 0.0182 0.0384 0.038
Trypanosoma brucei lysyl-tRNA synthetase, putative 0.0025 0.0025 0.0028
Trypanosoma brucei glucose transporter 2A 0.0034 0.0047 0.0057
Mycobacterium tuberculosis Probable thymidylate synthase ThyA (ts) (TSASE) 0.1218 0.2753 0.275
Trypanosoma brucei THT1 - hexose transporter, putative 0.0034 0.0047 0.0057
Leishmania major glucose transporter, lmgt1 0.0034 0.0047 0.0057
Trichomonas vaginalis conserved hypothetical protein 0.0037 0.0054 0.0389
Plasmodium falciparum calcium-dependent protein kinase 5 0.0034 0.0046 0.0055
Schistosoma mansoni hypothetical protein 0.0182 0.0384 0.038
Plasmodium vivax calcium-dependent protein kinase 1, putative 0.0034 0.0046 0.0055
Trypanosoma cruzi isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0017 0.0008 0.0004
Echinococcus multilocularis calcium dependent protein kinase 0.0032 0.0041 0.0037
Trypanosoma cruzi prolyl-tRNA synthetase, putative 0.0039 0.0057 0.007
Echinococcus multilocularis solute carrier family 2, facilitated glucose 0.0111 0.0222 0.0217
Loa Loa (eye worm) sugar transporter 0.0016 0.0004 0.0004
Loa Loa (eye worm) hypothetical protein 0.0016 0.0004 0.0004
Trypanosoma cruzi dihydrofolate reductase-thymidylate synthase 0.3326 0.7569 1
Mycobacterium ulcerans thymidylate synthase 0.1218 0.2753 0.275
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0017 0.0008 0.0003
Loa Loa (eye worm) major facilitator superfamily transporter 0.0016 0.0004 0.0004
Echinococcus multilocularis transcription factor btf3 0.0037 0.0054 0.005
Brugia malayi bifunctional aminoacyl-tRNA synthetase 0.0033 0.0045 0.004
Schistosoma mansoni protein kinase 0.0034 0.0046 0.0042
Entamoeba histolytica hypothetical protein 0.0037 0.0054 1
Echinococcus granulosus General substrate transporter 0.0095 0.0186 0.0182
Mycobacterium tuberculosis Lysyl-tRNA synthetase 2 LysX 0.0021 0.0017 0.0012
Loa Loa (eye worm) thymidylate synthase 0.1218 0.2753 0.2753
Echinococcus granulosus calcium dependent protein kinase 0.0032 0.0041 0.0037
Echinococcus multilocularis NADP dependent isocitrate dehydrogenase 0.0017 0.0008 0.0003
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0034 0.0046 0.0042
Trichomonas vaginalis conserved hypothetical protein 0.0037 0.0054 0.0389
Leishmania major protein kinase, putative 0.0034 0.0046 0.0055
Trypanosoma cruzi transcription factor btf3, putative 0.0037 0.0054 0.0066
Mycobacterium tuberculosis Lysyl-tRNA synthetase 1 LysS (lysine--tRNA ligase 1) (LysRS 1) (lysine translase) 0.0021 0.0017 0.0012
Mycobacterium leprae Probable prolyl tRNA synthetase ProS 0.0033 0.0045 0.0028
Brugia malayi Calcium/calmodulin-dependent protein kinase type II alpha chain 0.0034 0.0046 0.0042
Echinococcus multilocularis lysyl tRNA synthetase 0.0025 0.0025 0.0021
Brugia malayi beta-NAC-like protein 0.0037 0.0054 0.005
Schistosoma mansoni hypothetical protein 0.0182 0.0384 0.038
Trypanosoma cruzi prolyl-tRNA synthetase, putative 0.0039 0.0057 0.007
Trichomonas vaginalis lysyl-tRNA synthetase, putative 0.0022 0.0018 0.0108
Toxoplasma gondii protein kinase, putative 0.0313 0.0683 0.0897
Giardia lamblia Prolyl-tRNA synthetase 0.0033 0.0045 1
Entamoeba histolytica protein kinase, putative 0.0034 0.0046 0.7185
Trypanosoma brucei isocitrate dehydrogenase [NADP], mitochondrial precursor, putative 0.0017 0.0008 0.0004
Echinococcus multilocularis dihydrofolate reductase 0.439 1 1
Brugia malayi lysyl-tRNA synthetase 0.0025 0.0025 0.0021
Loa Loa (eye worm) hypothetical protein 0.0016 0.0004 0.0004
Trypanosoma brucei THT1 - hexose transporter, putative 0.0034 0.0047 0.0057
Plasmodium falciparum lysine--tRNA ligase 0.0025 0.0025 0.0028
Toxoplasma gondii bifunctional dihydrofolate reductase-thymidylate synthase 0.3326 0.7569 1
Toxoplasma gondii NAC domain-containing protein 0.0037 0.0054 0.0066
Trichomonas vaginalis conserved hypothetical protein 0.0111 0.0222 0.1685
Loa Loa (eye worm) calcium/calmodulin-dependent protein kinase ID 0.0034 0.0046 0.0046
Plasmodium vivax hexose transporter 0.0111 0.0222 0.0287
Trichomonas vaginalis sugar transporter, putative 0.0034 0.0047 0.0332
Trichomonas vaginalis glucose transporter, putative 0.0034 0.0047 0.0332
Toxoplasma gondii cell-cycle-associated protein kinase MAPK, putative 0.0179 0.0377 0.0493
Echinococcus granulosus dihydrofolate reductase 0.439 1 1
Plasmodium vivax bifunctional dihydrofolate reductase-thymidylate synthase, putative 0.3326 0.7569 1
Plasmodium vivax calcium-dependent protein kinase, putative 0.0034 0.0046 0.0055
Plasmodium falciparum isocitrate dehydrogenase [NADP], mitochondrial 0.0017 0.0008 0.0004
Leishmania major prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative 0.0039 0.0057 0.007
Loa Loa (eye worm) hypothetical protein 0.0027 0.003 0.003
Trichomonas vaginalis CAMK family protein kinase 0.0034 0.0046 0.0325
Toxoplasma gondii calcium-dependent protein kinase CDPK2A 0.0034 0.0046 0.0055
Toxoplasma gondii isocitrate dehydrogenase 0.0017 0.0008 0.0004
Loa Loa (eye worm) hypothetical protein 0.0016 0.0004 0.0004
Echinococcus multilocularis General substrate transporter 0.0095 0.0186 0.0182
Toxoplasma gondii calcium-dependent protein kinase CDPK2B 0.0034 0.0046 0.0055
Plasmodium falciparum calcium-dependent protein kinase 1 0.0034 0.0046 0.0055
Brugia malayi thymidylate synthase 0.1218 0.2753 0.275
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 0.0034 0.0046 0.0042
Trypanosoma brucei glucose transporter, putative 0.0034 0.0047 0.0057
Mycobacterium tuberculosis Dihydrofolate reductase DfrA (DHFR) (tetrahydrofolate dehydrogenase) 0.439 1 1
Trichomonas vaginalis lysyl-tRNA synthetase, putative 0.0025 0.0025 0.0162
Trypanosoma brucei glucose transporter 1E 0.0034 0.0047 0.0057
Trypanosoma brucei glucose transporter, putative 0.0034 0.0047 0.0057
Brugia malayi Dihydrofolate reductase 0.439 1 1
Loa Loa (eye worm) hypothetical protein 0.0034 0.0046 0.0046
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0111 0.0222 0.0217
Entamoeba histolytica protein kinase, putative 0.0034 0.0046 0.7185
Trypanosoma brucei isocitrate dehydrogenase, putative 0.0017 0.0008 0.0004
Leishmania major prolyl-tRNA synthetase, putative,bifunctional aminoacyl-tRNA synthetase, putative 0.0039 0.0057 0.007
Schistosoma mansoni dihydrofolate reductase 0.439 1 1
Plasmodium falciparum calcium-dependent protein kinase 3 0.0034 0.0046 0.0055
Plasmodium vivax isocitrate dehydrogenase [NADP], mitochondrial, putative 0.0017 0.0008 0.0004
Trichomonas vaginalis conserved hypothetical protein 0.0034 0.0047 0.0332
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 1 0.0034 0.0046 0.0042
Trypanosoma brucei glucose transporter, putative 0.0034 0.0047 0.0057
Echinococcus granulosus thymidylate synthase 0.1218 0.2753 0.275
Schistosoma mansoni lysyl-tRNA synthetase 0.0025 0.0025 0.0021
Brugia malayi Cam kinase protein 1 0.0034 0.0046 0.0042
Mycobacterium leprae PROBABLE THYMIDYLATE SYNTHASE THYA (TS) (TSASE) 0.1218 0.2753 0.2741
Loa Loa (eye worm) hypothetical protein 0.0016 0.0004 0.0004
Trichomonas vaginalis sugar transporter, putative 0.0034 0.0047 0.0332
Loa Loa (eye worm) hypothetical protein 0.0016 0.0004 0.0004
Echinococcus granulosus calcium:calmodulin dependent protein kinase type 0.0034 0.0046 0.0042
Trypanosoma cruzi hexose transporter, putative 0.0034 0.0047 0.0057
Giardia lamblia Lysyl-tRNA synthetase 0.0025 0.0025 0.5182
Loa Loa (eye worm) hypothetical protein 0.0025 0.0025 0.0025
Loa Loa (eye worm) hypothetical protein 0.0033 0.0045 0.0045
Plasmodium vivax lysine--tRNA ligase, putative 0.0025 0.0025 0.0028
Echinococcus granulosus solute carrier family 2 facilitated glucose 0.0111 0.0222 0.0217
Loa Loa (eye worm) hypothetical protein 0.0016 0.0004 0.0004
Loa Loa (eye worm) hypothetical protein 0.0016 0.0004 0.0004
Loa Loa (eye worm) hypothetical protein 0.0016 0.0004 0.0004
Loa Loa (eye worm) hypothetical protein 0.0016 0.0004 0.0004
Schistosoma mansoni glutamyl-tRNA synthetase cytoplasmic (glutamate--tRNA ligase) (glurs) 0.0033 0.0045 0.004
Echinococcus multilocularis solute carrier family 2 facilitated glucose 0.0111 0.0222 0.0217
Schistosoma mansoni NADP-specific isocitrate dehydrogenase 0.0017 0.0008 0.0003
Mycobacterium tuberculosis Probable isocitrate dehydrogenase [NADP] Icd1 (oxalosuccinate decarboxylase) (IDH) (NADP+-specific ICDH) (IDP) 0.0017 0.0008 0.0003
Echinococcus multilocularis calcium:calmodulin dependent protein kinase type 0.0034 0.0046 0.0042
Trypanosoma brucei dihydrofolate reductase-thymidylate synthase 0.3326 0.7569 1
Brugia malayi Isocitrate dehydrogenase 0.0017 0.0008 0.0003
Trypanosoma cruzi dihydrofolate reductase-thymidylate synthase, putative 0.058 0.1293 0.1704
Plasmodium falciparum protein kinase 6 0.047 0.1042 0.1371

Activities

Activity type Activity value Assay description Source Reference
Change (functional) = -37 % Percent change in cAMP content of CHO (Chinese hamster ovary) cells expressing human Adenosine A1 receptor at 10 uM ChEMBL. 12593659
Change (functional) = -37 % Percent change in cAMP content of CHO (Chinese hamster ovary) cells expressing human Adenosine A1 receptor at 10 uM ChEMBL. 12593659
Change (functional) = 1 % Percent change in cAMP content of CHO (Chinese hamster ovary) cells expressing human Adenosine A1 receptor at 1 uM ChEMBL. 12593659
Change (functional) = 1 % Percent change in cAMP content of CHO (Chinese hamster ovary) cells expressing human Adenosine A1 receptor at 1 uM ChEMBL. 12593659
Change (functional) = 9 % Percent change in cAMP content of CHO (Chinese hamster ovary) cells expressing human Adenosine A1 receptor at 0.1 uM ChEMBL. 12593659
Change (functional) = 9 % Percent change in cAMP content of CHO (Chinese hamster ovary) cells expressing human Adenosine A1 receptor at 0.1 uM ChEMBL. 12593659
Change (functional) = 17 % Percent change in cAMP content of CHO (Chinese hamster ovary) cells expressing human Adenosine A1 receptor at 0.01 uM ChEMBL. 12593659
Change (functional) = 17 % Percent change in cAMP content of CHO (Chinese hamster ovary) cells expressing human Adenosine A1 receptor at 0.01 uM ChEMBL. 12593659
Inhibition (binding) = 0 % Ability to displace the binding of [3H]-ZM 241385, to the ligand binding site of CHO:hA2A (human Adenosine A2A receptor) at concentration of 10 microM ChEMBL. 12593659
Inhibition (binding) = 0 % Ability to displace the binding of [3H]-ZM 241385, to the ligand binding site of CHO:hA2A (human Adenosine A2A receptor) at concentration of 10 microM ChEMBL. 12593659
Inhibition (binding) = 13.5 % Ability to displace the binding of [3H]-DPCPX to the ligand binding site of CHO:hA1 (human Adenosine A1 receptor) at concentration of 10 microM ChEMBL. 12593659
Inhibition (binding) = 13.5 % Ability to displace the binding of [3H]-DPCPX to the ligand binding site of CHO:hA1 (human Adenosine A1 receptor) at concentration of 10 microM ChEMBL. 12593659
Inhibition (binding) = 19 % Ability to displace the binding of [3H]-MRE 3008-F20 to the ligand binding site of CHO:hA3 (human Adenosine receptor) at concentration of 10 microM ChEMBL. 12593659
Inhibition (binding) = 19 % Ability to displace the binding of [3H]-MRE 3008-F20 to the ligand binding site of CHO:hA3 (human Adenosine receptor) at concentration of 10 microM ChEMBL. 12593659

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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