BDBM50050689 CHEMBL3311543
SMILES: [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCCN(CC)CC)[C@@]1(C)CCCC2(C)C
InChI Key: InChIKey=DXCFTARDAMBCLY-HZMCFHPPSA-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Acetylcholinesterase (Tetronarce californica (Pacific electric ray) (Tor...) | BDBM50050689 (CHEMBL3311543) | PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 1.18E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidad Nacional del Sur Curated by ChEMBL | Assay Description Inhibition of Torpedo californica AChE by spectrophotometry based Ellman's method | Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Butyrylcholinesterase (BuChE) (Equus caballus (Horse)) | BDBM50050689 (CHEMBL3311543) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | Article PubMed | n/a | n/a | 1.81E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Universidad Nacional del Sur Curated by ChEMBL | Assay Description Inhibition of horse serum BChE by spectrophotometry based Ellman's method | Bioorg Med Chem 22: 3838-49 (2014) Article DOI: 10.1016/j.bmc.2014.06.030 BindingDB Entry DOI: 10.7270/Q2VT1TQC | |||||||||||
More data for this Ligand-Target Pair |