Neladalkib

Highest phase reached
Drug type
Small molecule

Listing at source
Listed
Highest phase reached

Drug type
Small molecule
Drug name
Neladalkib
Molecular weight
Structure (SMILES)
CCn1nc(Cl)c2c1-c1cnc(N)c(c1)O[C@H](C)c1cc(F)ccc1-c1nn(C)cc1C2

  • 4 8 metheno 8h dipyrazolo 3 4 h 4 3 k 2 5 benzoxaazacyclotetradecin 7 amine 1 chloro 3 ethyl 12 fluoro 3 10 16 18 tetrahydro 10 16 dimethyl 10r
  • 4,8-Metheno-8H-dipyrazolo[3,4-h:4′,3′-k][2,5]benzoxaazacyclotetradecin-7-amine, 1-chloro-3-ethyl-12-fluoro-3,10,16,18-tetrahydro-10,16-dimethyl-, (10R)-
  • neladalkib
  • Neladalkib
  • Neladalkib (NVL-655)
  • Neladalkib [INN]
  • Neladalkib [USAN]
  • Neladalkib [WHO-DD]
  • neladalkib inn
  • neladalkib nvl 655
  • neladalkib usan
  • neladalkib who dd
  • nuv 655
  • NUV-655
  • nvl 655
  • NVL-655

CAS registry numbers
  • 2739866-40-9
ChEMBL ID
CHEMBL6068023
InChIKey
FWZSCAQEBTVTOM-GFCCVEGCSA-N
PubChem compound IDs
  • 164718816
FDA ingredient codes (UNII)
  • J32P26A6BC

First in class
No
Orphan designation
No

Pharmacology name
neladalkib
Type
Synthetic organic
Drug name stem
-alkib

Mechanisms of action

  • Action
    Inhibition
    Action type
    Inhibitor
    Target
    ALK receptor tyrosine kinase
    Gene symbol
    ALK
    Protein identifier
    Q9UM73
    Median affinity
    9
    Affinity units
    pIC50

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_0005233
    Highest recorded phase
    3

Hydrogen bond acceptors
7
Hydrogen bond donors
1
Polar surface area
83.78
Calculated partition coefficient (ALogP)
4.78
Calculated partition coefficient (XLogP)
3.7
Prodrug
No
Chirality
Single enantiomer
Inorganic
No
Rule-of-five violations
0
Rotatable bonds
1
Heavy atoms
32
Molecular formula
C23H22ClFN6O
Monoisotopic mass
452.1527652
Natural product
No

Related records

Trials (3)

In development for (1)