Enpatoran

Highest phase reached
Drug type
Small molecule

Listing at source
Listed
Highest phase reached

Drug type
Small molecule
Drug name
Enpatoran
Molecular weight
Structure (SMILES)
N#Cc1ccc(N2C[C@H](N)C[C@H](C(F)(F)F)C2)c2cccnc12

  • enpatoran
  • Enpatoran
  • ENPATORAN
  • enpatoran [INN]
  • ENPATORAN [USAN]
  • Enpatoran [WHO-DD]
  • enpatoran inn
  • enpatoran usan
  • enpatoran who dd
  • m 5049
  • M-5049
  • m5049
  • M5049

CAS registry numbers
  • 2101938-42-3
ChEMBL ID
CHEMBL4802159
InChIKey
BJXYHBKEQFQVES-NWDGAFQWSA-N
PubChem compound IDs
  • 129240620
FDA ingredient codes (UNII)
  • 7CZ390V26X

First in class
No
Orphan designation
No

Pharmacology name
enpatoran
Type
Synthetic organic
Drug name stem
-toran

  • Action
    Antagonist
    Action type
    Antagonist
    Target
    TLR7
    Gene symbol
    TLR7
    Protein identifier
    Q9NYK1
    Median affinity
    6
    Affinity units
    pIC50
  • Mechanism
    Toll-like receptor 7 antagonist
    Action type
    Antagonist
    Target
    Toll-like receptor 7
    Protein identifier
    Q9NYK1
  • Mechanism
    Toll-like receptor 8 antagonist
    Action type
    Antagonist
    Target
    Toll-like receptor 8
    Protein identifier
    Q9NR97

  • Mechanism
    Toll-like receptor 7 antagonist
    Action type
    Antagonist
    Target
    Toll-like receptor 7
  • Mechanism
    Toll-like receptor 8 antagonist
    Action type
    Antagonist
    Target
    Toll-like receptor 8

  • Condition
    Dermatomyositis
    Highest recorded phase
    2
    Condition identifier
    EFO:0000398
    Subject identifier
    D003882
  • Condition
    Lupus Erythematosus, Cutaneous
    Highest recorded phase
    1
    Condition identifier
    EFO:0003834
    Subject identifier
    D008178
  • Condition
    Lupus Erythematosus, Systemic
    Highest recorded phase
    2
    Condition identifier
    MONDO:0007915
    Subject identifier
    D008180
  • Condition
    COVID-19
    Highest recorded phase
    1
    Condition identifier
    MONDO:0100096
    Subject identifier
    D000086382
  • Condition
    Severe Acute Respiratory Syndrome
    Highest recorded phase
    2
    Condition identifier
    MONDO:0100096
    Subject identifier
    D045169

  • Condition identifier
    EFO_0003834
    Highest recorded phase
    1
  • Condition identifier
    MONDO_0004670
    Highest recorded phase
    3
  • Condition identifier
    MONDO_0005282
    Highest recorded phase
    2
  • Condition identifier
    MONDO_0007915
    Highest recorded phase
    2
  • Condition identifier
    MONDO_0016367
    Highest recorded phase
    2
  • Condition identifier
    MONDO_0019127
    Highest recorded phase
    2
  • Condition identifier
    MONDO_0019558
    Highest recorded phase
    2
  • Condition identifier
    MONDO_0100096
  • Condition identifier
    MONDO_0100096
    Highest recorded phase
    2

Hydrogen bond acceptors
4
Hydrogen bond donors
1
Polar surface area
65.94
Calculated partition coefficient (ALogP)
2.82
Calculated partition coefficient (XLogP)
2.7
Prodrug
No
Chirality
Single enantiomer
Inorganic
No
Rule-of-five violations
0
Rotatable bonds
1
Heavy atoms
23
Molecular formula
C16H15F3N4
Monoisotopic mass
320.12488098
Natural product
No

Recorded assays
7
Active assays
2

Active assay types

  • Confirmatory

Related records

Trials (12)

In development for (4)

Targets (2)