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BDBM50231678 CHEMBL252057::N-((2S,3R)-4-(cyclohexylamino)-3-hydroxy-1-phenylbutan-2-yl)-3-(ethylamino)-5-(2-oxopyrrolidin-1-yl)benzamide::N-[(1S,2R)-1-benzyl-3-(cyclohexylamino)-2-hydroxypropyl]-3-(ethylamino)-5-(2-oxopyrrolidin-1-yl)benzamide
SMILES: CCNc1cc(cc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC1CCCCC1)N1CCCC1=O
InChI Key: InChIKey=PVDHVIVUNLQJLY-UHFFFAOYSA-N
Data: 3 IC50
| Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Beta-secretase 1 (Human) | BDBM50231678![]() (N-((2S,3R)-4-(cyclohexylamino)-3-hydroxy-1-phenylb...) | GoogleScholar | UniChem | n/a | n/a | 180 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Beta-secretase 2 (Human) | BDBM50231678![]() (N-((2S,3R)-4-(cyclohexylamino)-3-hydroxy-1-phenylb...) | GoogleScholar | UniChem | n/a | n/a | 5.01E+3 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Cathepsin D (Human) | BDBM50231678![]() (N-((2S,3R)-4-(cyclohexylamino)-3-hydroxy-1-phenylb...) | GoogleScholar | UniChem | n/a | n/a | 780 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||