Halofuginone

Basic Information

CAS ID: 55837-20-2
Molecular Formula: C16H17BrClN3O3
Molecular Weight: 414.7 g/mol
Monoisotopic Mass: 413.0142 g/mol
Class: Small Molecule
Natural Product: Yes
Other Names:
Analysis: Drug repositioning mechanism analysis

OH NH O N N Br Cl O

Compound Structure and Identifier

InChI: InChI=1S/C16H17BrClN3O3/c17-11-6-13-10(5-12(11)18)16(24)21(8-20-13)7-9(22)4-14-15(23)2-1-3-19-14/h5-6,8,14-15,19,23H,1-4,7H2/t14-,15+/m0/s1 See All
InChI Key: LVASCWIMLIKXLA-LSDHHAIUSA-N
Smiles: O[C@@H]1CCCN[C@H]1CC(=O)CN2C=Nc3cc(Br)c(Cl)cc3C2=O See All
Molfile: Download

Related Target

Target ID Name Interaction
T0279 Collagen alpha-1(I) chain inhibitor
T0280 Collagen alpha-2(I) chain inhibitor

Related Fibrosis Property

Reference Record 1

PubMed ID 28487390 Target ID
Uniprot ID Name
Model vitro,mice Fibrosis Disease Cardiac fibrosis
Process I
Process II
Process III prevenet collagen deposition
Mechanism Targeting amino acid response pathway

Reference Record 2

PubMed ID 23274062 Target ID
Uniprot ID Name
Model vitro,mice Fibrosis Disease Muscle fibrosis
Process I
Process II cells migration
Process III prevenet collagen deposition
Mechanism Targeting TGF-β signaling

Reference Record 3

PubMed ID 22327401 Target ID
Uniprot ID Name
Model vitro Fibrosis Disease Fibrosis
Process I
Process II
Process III prevenet collagen deposition
Mechanism

Reference Record 4

PubMed ID 16735800 Target ID T0279
Uniprot ID Collagen alpha-1(I) chain Name Collagen alpha-1(I) chain
Model vitro Fibrosis Disease Renal fibrosis
Process I
Process II fibroblasts proliferation
Process III
Mechanism Targeting MMP-2

Reference Record 5

PubMed ID 12482197 Target ID
Uniprot ID Name
Model mice Fibrosis Disease Skin fibrosis
Process I
Process II
Process III prevenet collagen deposition
Mechanism

Reference Record 6

PubMed ID 11705455 Target ID
Uniprot ID Name
Model mice Fibrosis Disease Dermal fibrosis
Process I
Process II
Process III prevenet collagen deposition
Mechanism

Reference Record 7

PubMed ID 11705455 Target ID T0279
Uniprot ID Collagen alpha-1(I) chain Name Collagen alpha-1(I) chain
Model vitro,mice Fibrosis Disease Dermal fibrosis
Process I
Process II
Process III prevenet collagen deposition
Mechanism

Reference Record 8

PubMed ID 11705455 Target ID T0280
Uniprot ID Collagen alpha-2(I) chain Name Collagen alpha-2(I) chain
Model vitro,mice Fibrosis Disease Dermal fibrosis
Process I
Process II
Process III prevenet collagen deposition
Mechanism

Reference Record 9

PubMed ID 29065190 Target ID
Uniprot ID Name
Model vitro,mice Fibrosis Disease Scleroderma
Process I
Process II
Process III prevenet collagen deposition
Mechanism

Related Link

PubChem: 400772
ChEMBL: CHEMBL1199539