Reaction Details Report a problem with these data
Target
Three-prime repair exonuclease 1
Ligand
BDBM550452
Substrate
n/a
Meas. Tech.
Exonuclease Assay
IC50
<1000±n/a nM
Citation
 Letourneau, JJ; Selvarangan Elamparuthi, K; Huang, C; Bommireddy Venkata, V Substituted pyrrolo[1,2-a]pyrazines and pyrrolo[1,2-a][1,4]diazepines as TREX1 inhibitors US Patent  US11306098 Publication Date 4/19/2022 
Target
Name:
Three-prime repair exonuclease 1
Synonyms:
3'-5' exonuclease TREX1 | DNase III | Deoxyribonuclease III | TREX1 | TREX1_HUMAN
Type:
Protein
Mol. Mass.:
33217.46
Organism:
Human
Description:
Q9NSU2
Residue:
314
Sequence:
MGSQALPPGPMQTLIFFDMEATGLPFSQPKVTELCLLAVHRCALESPPTSQGPPPTVPPPPRVVDKLSLCVAPGKACSPAASEITGLSTAVLAAHGRQCFDDNLANLLLAFLRRQPQPWCLVAHNGDRYDFPLLQAELAMLGLTSALDGAFCVDSITALKALERASSPSEHGPRKSYSLGSIYTRLYGQSPPDSHTAEGDVLALLSICQWRPQALLRWVDAHARPFGTIRPMYGVTASARTKPRPSAVTTTAHLATTRNTSPSLGESRGTKDLPPVKDPGALSREGLLAPLGLLAILTLAVATLYGLSLATPGE
  
Inhibitor
Name:
BDBM550452
Synonyms:
US11306098, Example 18 | US11583538, Example 18
Type:
Small organic molecule
Emp. Form.:
C28H36Cl2N4O2S
Mol. Mass.:
563.582
SMILES:
CC(C)C[C@@H](N1CCC(CSc2ccccc2)N2C[C@H](N)C[C@H]2C1=O)C(=O)NCc1ccc(Cl)c(Cl)c1 |r|
Structure:
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