Reaction Details | |||
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Target | Presenilin-1 | ||
Ligand | BDBM50483741 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_745101 (CHEMBL1772227) | ||
IC50 | 73±n/a nM | ||
Citation | Brodney, MA; Auperin, DD; Becker, SL; Bronk, BS; Brown, TM; Coffman, KJ; Finley, JE; Hicks, CD; Karmilowicz, MJ; Lanz, TA; Liston, D; Liu, X; Martin, BA; Nelson, RB; Nolan, CE; Oborski, CE; Parker, CP; Richter, KE; Pozdnyakov, N; Sahagan, BG; Schachter, JB; Sokolowski, SA; Tate, B; Van Deusen, JW; Wood, DE; Wood, KM Diamide amino-imidazoles: a novel series of ?-secretase inhibitors for the treatment of Alzheimer's disease. Bioorg Med Chem Lett21:2631-6 (2011) [PubMed] Article | ||
More Info.: | Get all data from this article, Assay Method | ||
Presenilin-1 | |||
Name: | Presenilin-1 | ||
Synonyms: | 3.4.23.- | AD3 | Gamma-Secretase Subunit Presenilin-1 | PS-1 | PS1 | PS1-CTF12 | PSEN1 | PSN1_HUMAN | PSNL1 | Presenilin-1 CTF subunit | Presenilin-1 CTF12 | Presenilin-1 NTF subunit | Protein S182 | ||
Type: | n/a | ||
Mol. Mass.: | 52657.13 | ||
Organism: | Homo sapiens (Human) | ||
Description: | P49768 | ||
Residue: | 467 | ||
Sequence: |
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BDBM50483741 | |||
n/a | |||
Name | BDBM50483741 | ||
Synonyms: | CHEMBL1770896 | ||
Type | Small organic molecule | ||
Emp. Form. | C26H37F2N5O3 | ||
Mol. Mass. | 505.6005 | ||
SMILES | CCC[C@H](NC(=O)Cc1cc(F)cc(F)c1)C(=O)Nc1cn(cn1)C(C)(C)CNC1CCC(O)CC1 |r,wD:3.2,(1.85,-45.75,;1.84,-44.21,;.5,-43.44,;.5,-41.9,;-.84,-41.14,;-2.17,-41.91,;-2.16,-43.45,;-3.51,-41.15,;-4.84,-41.92,;-6.17,-41.16,;-7.5,-41.93,;-8.83,-41.16,;-7.5,-43.47,;-6.17,-44.25,;-6.17,-45.79,;-4.83,-43.47,;1.83,-41.13,;1.82,-39.59,;3.17,-41.89,;4.5,-41.12,;5.9,-41.74,;6.93,-40.59,;6.15,-39.26,;4.65,-39.59,;8.25,-39.81,;7.47,-38.48,;9.34,-38.72,;9.59,-40.57,;10.92,-39.79,;10.9,-38.26,;12.22,-37.48,;12.2,-35.96,;10.87,-35.2,;10.85,-33.66,;9.55,-35.98,;9.56,-37.52,)| | ||
Structure |