Reaction Details | |||
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Target | Acetylcholine-binding protein | ||
Ligand | BDBM50399818 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_665337 (CHEMBL1261014) | ||
Kd | 219±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 Chem53:7192-201 (2010) [PubMed] Article | ||
More Info.: | Get all data from this article, Assay Method | ||
Acetylcholine-binding protein | |||
Name: | Acetylcholine-binding protein | ||
Synonyms: | ACHP_LYMST | 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: |
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BDBM50399818 | |||
n/a | |||
Name | BDBM50399818 | ||
Synonyms: | CHEMBL1257896 | ||
Type | Small organic molecule | ||
Emp. Form. | C20H23N3O | ||
Mol. Mass. | 321.4161 | ||
SMILES | O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1ccccc1 |r,wU:3.2,wD:10.12,TLB:11:10:6.5:8.9,THB:2:3:6.5:8.9,(23.13,-6.85,;23.15,-5.31,;21.83,-4.52,;20.48,-5.27,;19.01,-4.63,;17.66,-5.24,;17.38,-6.63,;18.75,-6,;18.5,-4.09,;18.94,-2.99,;20.29,-6.65,;21.05,-7.99,;20.26,-9.32,;18.72,-9.3,;17.94,-10.63,;18.7,-11.97,;20.25,-11.98,;21.03,-10.65,;24.49,-4.55,;25.81,-5.34,;27.16,-4.59,;27.18,-3.05,;25.84,-2.26,;24.51,-3.02,)| | ||
Structure |