BDBM50053947 2-(4-Methylamino-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-6-ylsulfanyl)-hexanoic acid amide::CHEMBL60962
SMILES: CCCCC(Sc1nc(NC)c2cnn(-c3ccccc3)c2n1)C(N)=O
InChI Key: InChIKey=MEUJEXCPMKJKPI-UHFFFAOYSA-N
Data: 5 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 A1 (Rattus norvegicus (rat)) | BDBM50053947 (2-(4-Methylamino-1-phenyl-1H-pyrazolo[3,4-d]pyrimi...) | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article | 0.740 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Inhibition of A1 agonist (R)-[3H]-N 6-(phenylisopropyl) adenosine binding to membranes from rat whole brain | Bioorg Med Chem Lett 6: 357-360 (1996) Article DOI: 10.1016/0960-894X(96)00027-3 BindingDB Entry DOI: 10.7270/Q2HQ3ZWW | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Adenosine receptor A1 (Rattus norvegicus (rat)) | BDBM50053947 (2-(4-Methylamino-1-phenyl-1H-pyrazolo[3,4-d]pyrimi...) | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 0.745 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Griffith University Curated by ChEMBL | Assay Description Displacement of [3H]-N6-PIA from Adenosine A1 receptor from rat whole brain | J Med Chem 39: 4156-61 (1996) Article DOI: 10.1021/jm960052s BindingDB Entry DOI: 10.7270/Q29Z9404 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Adenosine receptor A1 (Rattus norvegicus (rat)) | BDBM50053947 (2-(4-Methylamino-1-phenyl-1H-pyrazolo[3,4-d]pyrimi...) | PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 0.745 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca R&D Griffith University Curated by ChEMBL | Assay Description Displacement of [3H]-N6-PIA binding from A1 receptor in whole rat brain membranes | Bioorg Med Chem Lett 11: 191-3 (2001) BindingDB Entry DOI: 10.7270/Q23F4NW2 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Adenosine Receptors A2a (A2a) (Rattus norvegicus (rat)) | BDBM50053947 (2-(4-Methylamino-1-phenyl-1H-pyrazolo[3,4-d]pyrimi...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article | 247 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Inhibition of A2a agonist [3H]-CGS- 21680 binding to rat striatal membranes | Bioorg Med Chem Lett 6: 357-360 (1996) Article DOI: 10.1016/0960-894X(96)00027-3 BindingDB Entry DOI: 10.7270/Q2HQ3ZWW | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Adenosine Receptors A2a (A2a) (Rattus norvegicus (rat)) | BDBM50053947 (2-(4-Methylamino-1-phenyl-1H-pyrazolo[3,4-d]pyrimi...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 247 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Griffith University Curated by ChEMBL | Assay Description Inhibition of [3H]-CGS-21,680 binding to Adenosine A2A receptor of rat striatal membranes | J Med Chem 39: 4156-61 (1996) Article DOI: 10.1021/jm960052s BindingDB Entry DOI: 10.7270/Q29Z9404 | |||||||||||
More data for this Ligand-Target Pair |