BDBM50161789 CHEMBL369554::Ethyl-carbamic acid 3a-methyl-2,3,3a,8a-tetrahydro-benzo[b]furo[3,2-d]furan-5-yl ester
SMILES: CCNC(=O)Oc1ccc2OC3OCCC3(C)c2c1
InChI Key: InChIKey=ZEZHVLKHFYAVTB-UHFFFAOYSA-N
Data: 2 IC50
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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Acetylcholinesterase (Homo sapiens (Human)) | BDBM50161789![]() (CHEMBL369554 | Ethyl-carbamic acid 3a-methyl-2,3,3...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 360 | n/a | n/a | n/a | n/a | n/a | n/a |
National Institute on Aging Curated by ChEMBL | Assay Description Inhibitory concentration against human erythrocyte Acetylcholinesterase | J Med Chem 48: 986-94 (2005) Article DOI: 10.1021/jm049309+ BindingDB Entry DOI: 10.7270/Q2TM7BWQ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Cholinesterase (Homo sapiens (Human)) | BDBM50161789![]() (CHEMBL369554 | Ethyl-carbamic acid 3a-methyl-2,3,3...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a |
National Institute on Aging Curated by ChEMBL | Assay Description Inhibitory concentration against human plasma Butyrylcholinesterase | J Med Chem 48: 986-94 (2005) Article DOI: 10.1021/jm049309+ BindingDB Entry DOI: 10.7270/Q2TM7BWQ | |||||||||||
More data for this Ligand-Target Pair |