Ki Summary

Reaction Details

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Target

Acetylcholine Binding protein

Ligand

BDBM50393247

Substrate/Competitor

n/a

Meas. Tech.

ChEMBL_665339

14.45±n/a nM

Citation

de Kloe GE; Retra K; Geitmann M; Källblad P; Nahar T; van Elk R; Smit AB; van Muijlwijk-Koezen JE; Leurs R; Irth H; Danielson UH; de Esch IJ Surface plasmon resonance biosensor based fragment screening using acetylcholine binding protein identifies ligand efficiency hot spots (LE hot spots) by deconstruction of nicotinic acetylcholine receptora7 ligands. J Med Chem 53:7192-201 (2010) [PubMed] Article

More Info.:

Get all data from this article, Assay Method

Acetylcholine Binding protein

Name:

Acetylcholine Binding protein

Synonyms:

ACh-binding protein | Acetylcholine-binding protein | Acetylcholine-binding protein (AchBP) | Acetylcholine-binding protein (Ls-AchBP) | AchBP

Type:

n/a

Mol. Mass.:

26055.52

Organism:

Lymnaea stagnalis

Description:

Soluble acetylcholine receptor

Residue:

229

Sequence:

MRRNIFCLACLWIVQACLSLDRADILYNIRQTSRPDVIPTQRDRPVAVSVSLKFINILEV
NEITNEVDVVFWQQTTWSDRTLAWNSSHSPDQVSVPISSLWVPDLAAYNAISKPEVLTPQ
LARVVSDGEVLYMPSIRQRFSCDVSGVDTESGATCRIKIGSWTHHSREISVDPTTENSDD
SEYFSQYSRFEILDVTQKKNSVTYSCCPEAYEDVEVSLNFRKKGRSEIL

BDBM50393247

n/a

Name

BDBM50393247

Synonyms:

CHEMBL1258006

Type

Small organic molecule

Emp. Form.

C22H23N3O2

Mol. Mass.

361.4369

SMILES

O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1cc2ccccc2o1 |r,wU:3.2,wD:10.12,TLB:11:10:6.5:8.9,THB:2:3:6.5:8.9,(5.71,-17.16,;5.73,-15.62,;4.4,-14.83,;3.06,-15.59,;1.59,-14.95,;.24,-15.55,;-.04,-16.95,;1.33,-16.32,;1.07,-14.41,;1.52,-13.3,;2.87,-16.97,;3.63,-18.31,;2.84,-19.64,;1.3,-19.62,;.52,-20.94,;1.28,-22.29,;2.83,-22.3,;3.61,-20.97,;7.07,-14.87,;7.24,-13.35,;8.76,-13.04,;9.54,-11.72,;11.07,-11.74,;11.83,-13.08,;11.04,-14.41,;9.51,-14.39,;8.47,-15.52,)|

Structure