Reaction Details Report a problem with these data
Target
Serine hydroxymethyltransferase, cytosolic
Ligand
BDBM512954
Substrate
n/a
Meas. Tech.
SHMT1 and SHMT2 Activity Assays
IC50
5500±n/a nM
Citation
 Mainolfi, N SHMT inhibitors and uses thereof US Patent  US11091451 Publication Date 8/17/2021 
Target
Name:
Serine hydroxymethyltransferase, cytosolic
Synonyms:
GLYC_HUMAN | Glycine hydroxymethyltransferase | SHMT | SHMT1 | Serine methylase
Type:
PROTEIN
Mol. Mass.:
53091.10
Organism:
Homo sapiens (Human)
Description:
ChEMBL_745716
Residue:
483
Sequence:
MTMPVNGAHKDADLWSSHDKMLAQPLKDSDVEVYNIIKKESNRQRVGLELIASENFASRAVLEALGSCLNNKYSEGYPGQRYYGGTEFIDELETLCQKRALQAYKLDPQCWGVNVQPYSGSPANFAVYTALVEPHGRIMGLDLPDGGHLTHGFMTDKKKISATSIFFESMPYKVNPDTGYINYDQLEENARLFHPKLIIAGTSCYSRNLEYARLRKIADENGAYLMADMAHISGLVAAGVVPSPFEHCHVVTTTTHKTLRGCRAGMIFYRKGVKSVDPKTGKEILYNLESLINSAVFPGLQGGPHNHAIAGVAVALKQAMTLEFKVYQHQVVANCRALSEALTELGYKIVTGGSDNHLILVDLRSKGTDGGRAEKVLEACSIACNKNTCPGDRSALRPSGLRLGTPALTSRGLLEKDFQKVAHFIHRGIELTLQIQSDTGVRATLKEFKERLAGDKYQAAVQALREEVESFASLFPLPGLPDF
  
Inhibitor
Name:
BDBM512954
Synonyms:
US11091451, Compound I-20
Type:
Small organic molecule
Emp. Form.:
C23H21ClN2O3
Mol. Mass.:
408.877
SMILES:
CC(C)(NC(=O)Cc1ccnc(c1)-c1ccc(Cl)cc1-c1ccccc1)C(O)=O
Structure:
Search PDB for entries with ligand similarity: