Reaction Details Report a problem with these data
Target
Three-prime repair exonuclease 1
Ligand
BDBM550447
Substrate
n/a
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 | TREX1_MOUSE | Trex1
Type:
Protein
Mol. Mass.:
33681.13
Organism:
Mouse
Description:
Q91XB0
Residue:
314
Sequence:
MGSQTLPHGHMQTLIFLDLEATGLPSSRPEVTELCLLAVHRRALENTSISQGHPPPVPRPPRVVDKLSLCIAPGKACSPGASEITGLSKAELEVQGRQRFDDNLAILLRAFLQRQPQPCCLVAHNGDRYDFPLLQTELARLSTPSPLDGTFCVDSIAALKALEQASSPSGNGSRKSYSLGSIYTRLYWQAPTDSHTAEGDVLTLLSICQWKPQALLQWVDEHARPFSTVKPMYGTPATTGTTNLRPHAATATTPLATANGSPSNGRSRRPKSPPPEKVPEAPSQEGLLAPLSLLTLLTLAIATLYGLFLASPGQ
  
Inhibitor
Name:
BDBM550447
Synonyms:
US11306098, Example 14A | US11306098, Example 14B | US11583538, Example 105
Type:
Small organic molecule
Emp. Form.:
C28H34Cl2N4O4
Mol. Mass.:
561.5
SMILES:
N[C@@H]1C[C@@H]2N(C1)C(CCc1ccccc1)CCN([C@H](CCC(O)=O)C(=O)NCc1ccc(Cl)c(Cl)c1)C2=O |r|
Structure:
Search PDB for entries with ligand similarity: