BDBM50020529 2-(Hydroxyimino-methyl)-3-methyl-1-(3-phenyl-propoxymethyl)-3H-imidazol-1-ium; chloride::CHEMBL34000
SMILES: Cn1cc[n+](COCCCc2ccccc2)c1CN=O
InChI Key: InChIKey=GYGWQEBSBLGTRJ-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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Acetylcholinesterase (Electrophorus electricus (Electric eel)) | BDBM50020529![]() (2-(Hydroxyimino-methyl)-3-methyl-1-(3-phenyl-propo...) | UniProtKB/SwissProt GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem | PubMed | 4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
SRI International Curated by ChEMBL | Assay Description Compound was tested for the competitive inhibition of phosphonylation of Eel acetylcholinesterase (AChE) | J Med Chem 32: 493-503 (1989) BindingDB Entry DOI: 10.7270/Q2JD4XCB | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Muscarinic acetylcholine receptor (Mus musculus-MOUSE) | BDBM50020529![]() (2-(Hydroxyimino-methyl)-3-methyl-1-(3-phenyl-propo...) | PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem | PubMed | n/a | n/a | 2.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
SRI International Curated by ChEMBL | Assay Description Compound was tested for the binding affinity towards muscarinic receptor in mouse brain membrane | J Med Chem 32: 493-503 (1989) BindingDB Entry DOI: 10.7270/Q2JD4XCB | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Acetylcholinesterase (Bos taurus (bovine)) | BDBM50020529![]() (2-(Hydroxyimino-methyl)-3-methyl-1-(3-phenyl-propo...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem | PubMed | n/a | n/a | 3.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
SRI International Curated by ChEMBL | Assay Description Inhibition of acetylcholinesterase (AChE) in bovine erythrocyte(RBC) | J Med Chem 32: 493-503 (1989) BindingDB Entry DOI: 10.7270/Q2JD4XCB | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Acetylcholinesterase (Electrophorus electricus (Electric eel)) | BDBM50020529![]() (2-(Hydroxyimino-methyl)-3-methyl-1-(3-phenyl-propo...) | UniProtKB/SwissProt GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem | PubMed | n/a | n/a | 1.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
SRI International Curated by ChEMBL | Assay Description Inhibition of eel acetylcholinesterase (AChE) activity by 50% | J Med Chem 32: 493-503 (1989) BindingDB Entry DOI: 10.7270/Q2JD4XCB | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Acetylcholinesterase (Homo sapiens (Human)) | BDBM50020529![]() (2-(Hydroxyimino-methyl)-3-methyl-1-(3-phenyl-propo...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem | PubMed | n/a | n/a | 2.12E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
SRI International Curated by ChEMBL | Assay Description Concentration required to inhibit 50% of acetylcholinesterase (AChE) in human erythrocyte(RBC). | J Med Chem 32: 493-503 (1989) BindingDB Entry DOI: 10.7270/Q2JD4XCB | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Choline Acetyltransferase (RAT) | BDBM50020529![]() (2-(Hydroxyimino-methyl)-3-methyl-1-(3-phenyl-propo...) | PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet ![]() | CHEMBL PC cid PC sid UniChem | PubMed | n/a | n/a | 1.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
SRI International Curated by ChEMBL | Assay Description Compound was tested for the competitive inhibition of acetylcholinesterase (AChE) | J Med Chem 32: 493-503 (1989) BindingDB Entry DOI: 10.7270/Q2JD4XCB | |||||||||||
More data for this Ligand-Target Pair |