Sitokiren

Highest phase reached
Drug type
Small molecule

Listing at source
Listed
Highest phase reached

Drug type
Small molecule
Drug name
Sitokiren
Molecular weight
Structure (SMILES)
COC(=O)NCCCn1nc([C@@H](C)N(C(=O)[C@H]2CNCCO2)C2CC2)c2ccc(C)nc21

  • sitokiren
  • Sitokiren
  • SITOKIREN
  • sitokiren [INN]
  • sitokiren inn
  • sitokirene
  • Sitokirene
  • SITOKIRENE
  • sitokireno
  • Sitokireno
  • SITOKIRENO
  • sph 3127
  • Sph-3127
  • SPH-3127
  • sph3127
  • Sph3127
  • SPH3127
  • SPH3127 100mg
  • SPH3127 50mg
  • SPH3127 tablet

CAS registry numbers
  • 1399849-02-5
ChEMBL ID
CHEMBL4110551
InChIKey
GRTDDIZIUSADLD-CRAIPNDOSA-N
PubChem compound IDs
  • 117877477
FDA ingredient codes (UNII)
  • C2M78A9V6Z

First in class
No
Orphan designation
No

Pharmacology name
sitokiren
Type
Synthetic organic
Drug name stem
-kiren
Approval recorded by Guide to Pharmacology
Yes

  • Action
    Inhibition
    Action type
    Inhibitor
    Target
    renin
    Gene symbol
    REN
    Protein identifier
    P00797
    Median affinity
    9.4
    Affinity units
    pIC50
  • Mechanism
    Renin inhibitor
    Action type
    Inhibitor
    Target
    Renin
    Protein identifier
    P00797

Open Targets mechanisms

  • Mechanism
    Renin inhibitor
    Action type
    Inhibitor
    Target
    Renin

  • Condition
    Diabetic Nephropathies
    Highest recorded phase
    2
    Condition identifier
    EFO:0000401
    Subject identifier
    D003928
  • Condition
    Hypertension
    Highest recorded phase
    2
    Condition identifier
    EFO:0000537
    Subject identifier
    D006973
  • Condition
    Colitis, Ulcerative
    Highest recorded phase
    2
    Condition identifier
    EFO:0000729
    Subject identifier
    D003093
  • Condition
    Essential Hypertension
    Highest recorded phase
    3
    Condition identifier
    MONDO:0001134
    Subject identifier
    D000075222

  • Condition identifier
    EFO_0000537
    Highest recorded phase
    2
  • Condition identifier
    EFO_0000729
    Highest recorded phase
    2
  • Condition identifier
    HP_0000822
    Highest recorded phase
    2
  • Condition identifier
    MONDO_0001134
    Highest recorded phase
    3
  • Condition identifier
    MONDO_0005016
    Highest recorded phase
    2
  • Condition identifier
    MONDO_0005101
    Highest recorded phase
    2

Hydrogen bond acceptors
8
Hydrogen bond donors
2
Polar surface area
110.61
Calculated partition coefficient (ALogP)
1.53
Calculated partition coefficient (XLogP)
0.8
Prodrug
No
Chirality
Single enantiomer
Inorganic
No
Rule-of-five violations
0
Rotatable bonds
8
Heavy atoms
32
Molecular formula
C22H32N6O4
Monoisotopic mass
444.24850352
Natural product
No

Recorded assays
22
Active assays
4

Active assay types

  • Confirmatory

These details could not be displayed.

Related records

Trials (10)

In development for (4)

Targets (1)