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Target
Three-prime repair exonuclease 1
Ligand
BDBM550455
Substrate
n/a
IC50
>100000±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:
BDBM550455
Synonyms:
(2R)—N-(3,4-dichlorobenzyl)-2-((8R,9aS)-8-(dimethylamino)-1-oxo-5-phenethylhexahydro-1H-pyrrolo[1,2-a][1,4]diazepin-2(3H)-yl)-4-methylpentanamide HCl | US11306098, Example 21 | US11583538, Example 128
Type:
Small organic molecule
Emp. Form.:
C31H42Cl2N4O2
Mol. Mass.:
573.597
SMILES:
CC(C)C[C@@H](N1CCC(CCc2ccccc2)N2C[C@@H](C[C@H]2C1=O)N(C)C)C(=O)NCc1ccc(Cl)c(Cl)c1 |r|
Structure:
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