Reaction Details Report a problem with these data
Target
Microtubule-associated proteins 1A/1B light chain 3B
Ligand
BDBM500017
Substrate
n/a
Meas. Tech.
Assay Targeting LC3B
IC50
<3±n/a nM
Citation
 Yao, Z; Luo, C; Xie, Y; Yue, L; Wan, W; Zhang, Y; Jiang, H; Chen, K Class of isoindolone-imide ring-1,3-dione-2-ene compounds, composition and use thereof US Patent  US11021457 Publication Date 6/1/2021 
Target
Name:
Microtubule-associated proteins 1A/1B light chain 3B
Synonyms:
Autophagy-related protein LC3 B | Autophagy-related ubiquitin-like modifier LC3 B | MAP1 light chain 3-like protein 2 | MAP1A/MAP1B LC3 B | MAP1A/MAP1B light chain 3 B | MAP1ALC3 | MAP1LC3B | MLP3B_HUMAN | Microtubule-associated protein 1 light chain 3 beta
Type:
Protein
Mol. Mass.:
14691.38
Organism:
Human
Description:
Q9GZQ8
Residue:
125
Sequence:
MPSEKTFKQRRTFEQRVEDVRLIREQHPTKIPVIIERYKGEKQLPVLDKTKFLVPDHVNMSELIKIIRRRLQLNANQAFFLLVNGHSMVSVSTPISEVYESEKDEDGFLYMVYASQETFGMKLSV
  
Inhibitor
Name:
BDBM500017
Synonyms:
US11021457, Compound 21
Type:
Small organic molecule
Emp. Form.:
C27H22F3N3O5
Mol. Mass.:
525.4759
SMILES:
FC(F)(F)c1ccc(cc1)C1CC(=O)C(=CNc2cccc3C(=O)N(Cc23)C2CCC(=O)NC2=O)C(=O)C1 |(-2.93,-9.47,;-2.93,-7.93,;-4.47,-7.93,;-1.39,-7.93,;-2.93,-6.39,;-4.26,-5.57,;-4.26,-4.03,;-2.93,-3.26,;-1.6,-4.03,;-1.6,-5.57,;-2.93,-1.72,;-4.26,-.95,;-4.26,.59,;-5.6,1.36,;-2.93,1.36,;-2.93,2.9,;-4.26,3.67,;-4.26,5.21,;-5.6,5.98,;-5.6,7.52,;-4.26,8.29,;-2.93,7.52,;-1.47,8,;-.7,9.33,;-.56,6.75,;-1.47,5.51,;-2.93,5.98,;.98,6.75,;1.75,5.42,;3.29,5.42,;4.06,6.75,;5.6,6.75,;3.29,8.08,;1.75,8.08,;.98,9.42,;-1.6,.59,;-.26,1.36,;-1.6,-.95,)|
Structure:
Search PDB for entries with ligand similarity: