BDBM21210 N-[6-(3,5-dimethyl-1H-pyrazol-1-yl)-2-(5-methylfuran-2-yl)pyrimidin-4-yl]-2-[(3S)-3-[(dimethylamino)methyl]pyrrolidin-1-yl]acetamide::Pyrimidin-4-ylacetamide, 24
SMILES: CN(C)C[C@@H]1CCN(CC(=O)Nc2cc(nc(n2)-c2ccc(C)o2)-n2nc(C)cc2C)C1
InChI Key: InChIKey=UAAYMUFGVDVSAW-SFHVURJKSA-N
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 A2a (Homo sapiens (Human)) | BDBM21210 (N-[6-(3,5-dimethyl-1H-pyrazol-1-yl)-2-(5-methylfur...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 2.10 | -11.7 | n/a | n/a | n/a | n/a | n/a | 7.4 | 22 |
Neuroscience | Assay Description The membranes prepared from Flp-In HEK cells transfected with adenosine receptors were used in binding assays. Nonspecific binding was determined in ... | J Med Chem 51: 1730-9 (2008) Article DOI: 10.1021/jm701187w BindingDB Entry DOI: 10.7270/Q2RF5S9C | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Adenosine Receptors A2a (A2a) (Rattus norvegicus (rat)) | BDBM21210 (N-[6-(3,5-dimethyl-1H-pyrazol-1-yl)-2-(5-methylfur...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 27.8 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neuroscience | Assay Description The membranes prepared from Flp-In HEK cells transfected with adenosine receptors were used in binding assays. Nonspecific binding was determined in ... | J Med Chem 51: 1730-9 (2008) Article DOI: 10.1021/jm701187w BindingDB Entry DOI: 10.7270/Q2RF5S9C | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Adenosine receptor A1 (Homo sapiens (Human)) | BDBM21210 (N-[6-(3,5-dimethyl-1H-pyrazol-1-yl)-2-(5-methylfur...) | PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | 220 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Neuroscience | Assay Description The membranes prepared from Flp-In HEK cells transfected with adenosine receptors were used in binding assays. Nonspecific binding was determined in ... | J Med Chem 51: 1730-9 (2008) Article DOI: 10.1021/jm701187w BindingDB Entry DOI: 10.7270/Q2RF5S9C | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human)) | BDBM21210 (N-[6-(3,5-dimethyl-1H-pyrazol-1-yl)-2-(5-methylfur...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 1.01E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Neuroscience | Assay Description A preclinical assay was used to determine whether drug candidates inhibit hERG by examining their ability to block the potassium tail currents in HEK... | J Med Chem 51: 1730-9 (2008) Article DOI: 10.1021/jm701187w BindingDB Entry DOI: 10.7270/Q2RF5S9C | |||||||||||
More data for this Ligand-Target Pair |