FASUDIL

Search structure
Synonyms:
Status: Phase 3
Entry Type: Small molecule
Molecule Category: Parent
ATC: C04AX32
UNII: Q0CH43PGXS

Structure
InChI Key NGOGFTYYXHNFQH-UHFFFAOYSA-N
Smile O=S(=O)(c1cccc2cnccc12)N1CCCNCC1
InChI
InChI=1S/C14H17N3O2S/c18-20(19,17-9-2-6-15-8-10-17)14-4-1-3-12-11-16-7-5-13(12)14/h1,3-5,7,11,15H,2,6,8-10H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C14H17N3O2S
Molecular Weight 291.38
AlogP 1.22
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 2.0
Polar Surface Area 62.3
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 20.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR Rho-associated protein kinase inhibitor PubMed
Primary Target
Rho associated coiled-coil containing protein kinase 1
Rho associated coiled-coil containing protein kinase 2
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Kinase Protein Kinase AGC protein kinase group AGC protein kinase AKT family
- - - - 88
Enzyme Kinase Protein Kinase AGC protein kinase group AGC protein kinase DMPK family AGC protein kinase ROCK subfamily
- 158-11749 78 100-530 32-53
Enzyme Kinase Protein Kinase AGC protein kinase group AGC protein kinase PKA family
- - - 460 -
Enzyme Kinase Protein Kinase AGC protein kinase group AGC protein kinase PKC family AGC protein kinase PKC alpha subfamily
- - - - 86
Enzyme Kinase Protein Kinase AGC protein kinase group AGC protein kinase PKC family AGC protein kinase PKC eta subfamily
- 3000-3000 - - -
Enzyme Kinase Protein Kinase AGC protein kinase group AGC protein kinase PKN family
- 780-4000 - - 15
Enzyme Kinase Protein Kinase AGC protein kinase group AGC protein kinase RSK family AGC protein kinase MSK subfamily
- 5000 - - 19
Enzyme Kinase Protein Kinase AGC protein kinase group AGC protein kinase RSK family AGC protein kinase p70 subfamily
- - - - 32
Enzyme Kinase Protein Kinase AGC protein kinase group AGC protein kinase SGK family
- - - - 92
Enzyme Kinase Protein Kinase Atypical protein kinase group Atypical protein kinase PDHK subfamily
- - - - 92
Enzyme Kinase Protein Kinase CAMK protein kinase group CAMK protein kinase CAMK1 family CAMK protein kinase CHK1 subfamily
- - - - 82
Enzyme Kinase Protein Kinase CAMK protein kinase group CAMK protein kinase MAPKAPK family CAMK protein kinase MAPKAPK subfamily
- - - - 90
Enzyme Kinase Protein Kinase CAMK protein kinase group CAMK protein kinase MLCK family
- 3600-21600 - 36000 93
Enzyme Kinase Protein Kinase CAMK protein kinase group CAMK protein kinase RSKb family CAMK protein kinase MSKb subfamily
- 5000 - - 19
Enzyme Kinase Protein Kinase CMGC protein kinase group CMGC protein kinase GSK family
- - - - 90
Enzyme Kinase Protein Kinase CMGC protein kinase group CMGC protein kinase MAPK family CMGC protein kinase ERK subfamily
- - - - 94
Enzyme Kinase Protein Kinase CMGC protein kinase group CMGC protein kinase MAPK family CMGC protein kinase JNK subfamily
- - - - 96
Enzyme Kinase Protein Kinase CMGC protein kinase group CMGC protein kinase MAPK family CMGC protein kinase p38 subfamily
- - - - 103
Enzyme Kinase Protein Kinase Other protein kinase group Other protein kinase CK2 family
- - - - 102
Enzyme Kinase Protein Kinase TK protein kinase group Tyrosine protein kinase Src family
- - - - 94
Enzyme Kinase Protein kinase regulatory subunit
- - - - 102
Ion channel Voltage-gated ion channel Potassium channels Voltage-gated potassium channel
- - - 25119 -
Membrane receptor Family A G protein-coupled receptor Peptide receptor (family A GPCR) Chemokine receptor CC chemokine receptor
- 35000 - - -

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Amyotrophic Lateral Sclerosis 2 D000690 ClinicalTrials
Retinal Vein Occlusion 2 D012170 ClinicalTrials
Retinopathy of Prematurity 2 D012178 ClinicalTrials
Dementia 2 D003704 ClinicalTrials

Related Entries

Scaffolds

Salt

Cross References

Resources Reference
CAS NUMBER 103745-39-7
ChEMBL CHEMBL38380
DrugBank DB08162
DrugCentral 1132
EPA CompTox DTXSID4048569
FDA SRS Q0CH43PGXS
Guide to Pharmacology 5181
PDB M77
PubChem 3547
SureChEMBL SCHEMBL4674
ZINC ZINC000000006486
CONTENTS