BDBM333246 (2S,3R,4S)-2-(8-((4-methylpiperazin-1-yl)amino)-[1,2,4]triazolo[4,3-a]pyrazin-3-yl)tetrahydrothiophene-3,4-diol::US10196396, Compound 41
SMILES: CN1CCN(CC1)Nc1nccn2c(nnc12)[C@@H]1SC[C@@H](O)[C@H]1O
InChI Key: InChIKey=MMFRGJFWQSOXIM-GMTAPVOTSA-N
Data: 3 KI
Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Adenosine receptor A3 (Homo sapiens (Human)) | BDBM333246 ((2S,3R,4S)-2-(8-((4-methylpiperazin-1-yl)amino)-[1...) | Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem | US Patent | <10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
HANDOK INC. US Patent | Assay Description HEK-293 cell membrane homogenates (32 μg protein), in which A3 adenosine receptors were expressed, are incubated for 120 min at 22° C. with 0.15... | US Patent US10196396 (2019) BindingDB Entry DOI: 10.7270/Q2DJ5HQC | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Adenosine receptor A1 (Homo sapiens (Human)) | BDBM333246 ((2S,3R,4S)-2-(8-((4-methylpiperazin-1-yl)amino)-[1...) | PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem | US Patent | 5.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
HANDOK INC. US Patent | Assay Description CHO cell membrane homogenates (40 μg protein), in which A1 adenosine receptors were expressed, are incubated for 60 min at 22° C. with 1 nM [3H]... | US Patent US10196396 (2019) BindingDB Entry DOI: 10.7270/Q2DJ5HQC | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Adenosine receptor A2a (Homo sapiens (Human)) | BDBM333246 ((2S,3R,4S)-2-(8-((4-methylpiperazin-1-yl)amino)-[1...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem | US Patent | 5.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
HANDOK INC. US Patent | Assay Description HEK-293 cell membrane homogenates (40 μg protein), in which A2a adenosine receptors were expressed, are incubated for 120 min at 22° C. with 6 n... | US Patent US10196396 (2019) BindingDB Entry DOI: 10.7270/Q2DJ5HQC | |||||||||||
More data for this Ligand-Target Pair |