BDBM50186590 8-isopropyl-2,6-diphenyl-9H-purine::CHEMBL204780::LUF-5956
SMILES: CC(C)c1nc2nc(nc(-c3ccccc3)c2[nH]1)-c1ccccc1
InChI Key: InChIKey=WOKKQPCDRVUEPM-UHFFFAOYSA-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 A1 (Homo sapiens (Human)) | BDBM50186590 (8-isopropyl-2,6-diphenyl-9H-purine | CHEMBL204780 ...) | PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 0.820 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Leiden/Amsterdam Center for Drug Research Curated by ChEMBL | Assay Description Displacement of [3H]DPCPX from human adenosine A1 receptor expressed in CHO cells | J Med Chem 49: 2861-7 (2006) Article DOI: 10.1021/jm050640i BindingDB Entry DOI: 10.7270/Q2348JZ4 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Adenosine receptor A3 (Homo sapiens (Human)) | BDBM50186590 (8-isopropyl-2,6-diphenyl-9H-purine | CHEMBL204780 ...) | Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 9.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Leiden/Amsterdam Center for Drug Research Curated by ChEMBL | Assay Description Displacement of [125I]AB-MECA from human adenosine A3 receptor expressed in HEK293 cells | J Med Chem 49: 2861-7 (2006) Article DOI: 10.1021/jm050640i BindingDB Entry DOI: 10.7270/Q2348JZ4 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Adenosine receptor A2a (Homo sapiens (Human)) | BDBM50186590 (8-isopropyl-2,6-diphenyl-9H-purine | CHEMBL204780 ...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 148 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Leiden/Amsterdam Center for Drug Research Curated by ChEMBL | Assay Description Displacement of [3H]ZM 241385 from human adenosine A2a receptor expressed in HEK293 cells | J Med Chem 49: 2861-7 (2006) Article DOI: 10.1021/jm050640i BindingDB Entry DOI: 10.7270/Q2348JZ4 | |||||||||||
More data for this Ligand-Target Pair |