Reaction Details Report a problem with these data
Target
2',5'-phosphodiesterase 12
Ligand
BDBM50532283
Substrate
n/a
Meas. Tech.
ChEMBL_1922385 (CHEMBL4425341)
IC50
0.800000±n/a nM
Citation
 Franzini, RM; Randolph, C Chemical Space of DNA-Encoded Libraries. J Med Chem 59:6629-44 (2016) [PubMed]  Article 
Target
Name:
2',5'-phosphodiesterase 12
Synonyms:
2-PDE | 3.1.13.4 | 3.1.4.- | Mitochondrial deadenylase | PDE12 | PDE12_HUMAN
Type:
PROTEIN
Mol. Mass.:
67351.24
Organism:
Homo sapiens
Description:
ChEMBL_119092
Residue:
609
Sequence:
MWRLPGARAALRVIRTAVEKLSRAEAGSQTAAGAMERAVVRCVPSEPKLSLSFALADGSHKNMQRDQSEPLGRVLSRIATNALKGHAKAAAAKKSRKSRPNASGGAACSGPGPEPAVFCEPVVKLYYREEAVAEDVLNVDAWQDGAVLQIGDVKYKVERNPPAFTELQLPRYIMAGFPVCPKLSLEFGDPASSLFRWYKEAKPGAAEPEVGVPSSLSPSSPSSSWTETDVEERVYTPSNADIGLRLKLHCTPGDGQRFGHSRELESVCVVEAGPGTCTFDHRHLYTKKVTEDALIRTVSYNILADTYAQTEFSRTVLYPYCAPYALELDYRQNLIQKELTGYNADVICLQEVDRAVFSDSLVPALEAFGLEGVFRIKQHEGLATFYRKSKFSLLSQHDISFYEALESDPLHKELLEKLVLYPSAQEKVLQRSSVLQVSVLQSTKDSSKRICVANTHLYWHPKGGYIRLIQMAVALAHIRHVSCDLYPGIPVIFCGDFNSTPSTGMYHFVINGSIPEDHEDWASNGEEERCNMSLTHFFKLKSACGEPAYTNYVGGFHGCLDYIFIDLNALEVEQVIPLPSHEEVTTHQALPSVSHPSDHIALVCDLKWK
  
Inhibitor
Name:
BDBM50532283
Synonyms:
CHEMBL4556129
Type:
Small organic molecule
Emp. Form.:
C31H27BrFN5O3
Mol. Mass.:
616.48
SMILES:
CCn1cc(-c2nc3cc(Br)c(cc3n2C)C(=O)N2CCO[C@H]([C@@H]2CO)c2ccc(F)cc2)c2ccc(cc12)C#N |r|
Structure:
Search PDB for entries with ligand similarity: