Reaction Details Report a problem with these data
Target
Serine hydroxymethyltransferase, mitochondrial [30-504]
Ligand
BDBM512964
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, mitochondrial [30-504]
Synonyms:
GLYM_HUMAN | SHMT2 | Serine hydroxymethyltransferase, mitochondrial (30-504)
Type:
Enzyme Catalytic Domain
Mol. Mass.:
52566.80
Organism:
Homo sapiens (Human)
Description:
aa 30-504
Residue:
475
Sequence:
NAAQTQTGEANRGWTGQESLSDSDPEMWELLQREKDRQCRGLELIASENFCSRAALEALGSCLNNKYSEGYPGKRYYGGAEVVDEIELLCQRRALEAFDLDPAQWGVNVQPYSGSPANLAVYTALLQPHDRIMGLDLPDGGHLTHGYMSDVKRISATSIFFESMPYKLNPKTGLIDYNQLALTARLFRPRLIIAGTSAYARLIDYARMREVCDEVKAHLLADMAHISGLVAAKVIPSPFKHADIVTTTTHKTLRGARSGLIFYRKGVKAVDPKTGREIPYTFEDRINFAVFPSLQGGPHNHAIAAVAVALKQACTPMFREYSLQVLKNARAMADALLERGYSLVSGGTDNHLVLVDLRPKGLDGARAERVLELVSITANKNTCPGDRSAITPGGLRLGAPALTSRQFREDDFRRVVDFIDEGVNIGLEVKSKTAKLQDFKSFLLKDSETSQRLANLRQRVEQFARAFPMPGFDEH
  
Inhibitor
Name:
BDBM512964
Synonyms:
US11091451, Compound I-28
Type:
Small organic molecule
Emp. Form.:
C16H14Cl2N2O3S
Mol. Mass.:
385.265
SMILES:
OC(=O)C1(CCC1)NC(=O)Cc1csc(n1)-c1ccc(Cl)cc1Cl
Structure:
Search PDB for entries with ligand similarity: