BDBM50084054 6'-Chloro-1-methyl-1,2,5,6-tetrahydro-[3,3']bipyridinyl; compound with (Z)-but-2-enedioic acid::CHEMBL1181055::CHEMBL154087
SMILES: CN1CCC=C(C1)c1ccc(Cl)nc1
InChI Key: InChIKey=YWDRNTZRCJXPPD-UHFFFAOYSA-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Neuronal acetylcholine receptor Alpha-4/Beta-2 (Homo sapiens (Human)) | BDBM50084054 (6'-Chloro-1-methyl-1,2,5,6-tetrahydro-[3,3']bipyri...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 2.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Targacept, Inc. Curated by ChEMBL | Assay Description Binding affinity to alpha4beta2 nAChR | J Med Chem 55: 9181-94 (2012) Article DOI: 10.1021/jm3006542 BindingDB Entry DOI: 10.7270/Q2W0972W | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Muscarinic acetylcholine receptor M2 (RAT) | BDBM50084054 (6'-Chloro-1-methyl-1,2,5,6-tetrahydro-[3,3']bipyri...) | PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 3.51E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Institute of Pharmacy and Biochemistry Curated by ChEMBL | Assay Description Inhibition of binding of [3H]-quinuclidinyl benzilate to Muscarinic acetylcholine receptor M2 in rat heart atria at 10e-5 M of compound concentration | Bioorg Med Chem Lett 10: 55-8 (2000) BindingDB Entry DOI: 10.7270/Q2VQ31X8 | |||||||||||
More data for this Ligand-Target Pair |