Setidegrasib

Highest phase reached
Drug type
Small molecule

Listing at source
Listed
Highest phase reached

Drug type
Small molecule
Drug name
Setidegrasib
Structure (SMILES)
c1n[nH]c2cc(c(C)c(c21)-c3c(OCc4ccc(cc4)-c5cn([C@H](C(=O)N6C[C@@H](C[C@H]6C(N[C@H](c7ccc(-c8c(ncs8)C)cc7)CO)=O)O)C(C)C)nn5)c9c(c(N%10[C@@]%11(CN[C@@]([H])(C%11)C%10)[H])nc(n9)OC%12CCOCC%12)cc3C%13CC%13)F

  • 2 pyrrolidinecarboxamide 1 2s 2 4 4 6 cyclopropyl 4 1s 4s 2 5 diazabicyclo 2 2 1 hept 2 yl 7 6 fluoro 5 methyl 1h indazol 4 yl 2 tetrahydro 2h pyran 4 yl oxy 8 quinazolinyl oxy methyl phenyl 1h 1 2 3 triazol 1 yl 3 methyl 1 oxobutyl 4 hydroxy n 1r 2 hydroxy 1 4 4 methyl 5 thiazolyl phenyl ethyl 2s 4r
  • 2-Pyrrolidinecarboxamide, 1-[(2S)-2-[4-[4-[[[6-cyclopropyl-4-(1S,4S)-2,5-diazabicyclo[2.2.1]hept-2-yl-7-(6-fluoro-5-methyl-1H-indazol-4-yl)-2-[(tetrahydro-2H-pyran-4-yl)oxy]-8-quinazolinyl]oxy]methyl]phenyl]-1H-1,2,3-triazol-1-yl]-3-methyl-1-oxobutyl]-4-hydroxy-N-[(1R)-2-hydroxy-1-[4-(4-methyl-5-thiazolyl)phenyl]ethyl]-, (2S,4R)-
  • setidegrasib
  • Setidegrasib
  • setidegrasib [INN]
  • Setidegrasib [WHO-DD]
  • setidegrasib inn
  • setidegrasib who dd

CAS registry numbers
  • 2821793-99-9
ChEMBL ID
CHEMBL6068173
InChIKey
XXWMEQMGQNHRAF-WFJRNIGCSA-N
PubChem compound IDs
  • 164875418
FDA ingredient codes (UNII)
  • 3NQ4ME292X

First in class
No
Orphan designation
No

Drug name stem
-rasib

Investigated indications

  • Condition
    Neoplasms
    Highest recorded phase
    2
    Condition identifier
    EFO:0000616
    Subject identifier
    D009369

  • Condition identifier
    EFO_0000616
  • Condition identifier
    MONDO_0005070
  • Condition identifier
    MONDO_0005184
    Highest recorded phase
    2
  • Condition identifier
    MONDO_0005233
    Highest recorded phase
    3
  • Condition identifier
    MONDO_0006047
    Highest recorded phase
    3
  • Condition identifier
    MONDO_0009831
    Highest recorded phase
    3

Calculated partition coefficient (XLogP)
7.7
Prodrug
No
Chirality
Single enantiomer
Inorganic
No
Heavy atoms
81
Monoisotopic mass
1116.48039179
Natural product
No

Related records

Trials (4)

In development for (1)