Search and Browse
Download
Enter Data
| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Acetylcholine-binding protein | ||
| Ligand | BDBM50393247 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_665337 (CHEMBL1261014) | ||
| Kd | 20±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: |
| ||
| 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 | 
| ||