BDBM50026474 3,3-Dimethyl-butan-1-ol::CHEMBL25029
SMILES: CC(C)(C)CCO
InChI Key: InChIKey=DUXCSEISVMREAX-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 |
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Choline Acetyltransferase (RAT) | BDBM50026474![]() (3,3-Dimethyl-butan-1-ol | CHEMBL25029) | PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar | Purchase CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars | Article PubMed | 7.50E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Compound was evaluated for reversible inhibition of hydrolysis acetylcholine by acetylcholinesterase and represented as KI(noncompetitive) | J Med Chem 28: 1309-13 (1985) Article DOI: 10.1021/jm00147a033 BindingDB Entry DOI: 10.7270/Q26W994C | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Choline acetylase (RAT) | BDBM50026474![]() (3,3-Dimethyl-butan-1-ol | CHEMBL25029) | PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar | Purchase CHEMBL MMDB PC cid PC sid PDB UniChem Patents Similars | Article PubMed | 1.90E+7 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Compound was evaluated for reversible inhibition of hydrolysis acetylcholine by acetylcholinesterase and represented as KI(competitive) | J Med Chem 28: 1309-13 (1985) Article DOI: 10.1021/jm00147a033 BindingDB Entry DOI: 10.7270/Q26W994C | |||||||||||
More data for this Ligand-Target Pair |