PROTIRELIN

Search structure
Trade Names:
Synonyms:
Status: Approved (1976)
Entry Type: Protein
Molecule Category: UNKNOWN
ATC: V04CJ02
UNII: 5Y5F15120W

Structure
InChI Key XNSAINXGIQZQOO-SRVKXCTJSA-N
Smile NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H]1CCC(=O)N1
InChI
InChI=1S/C16H22N6O4/c17-14(24)12-2-1-5-22(12)16(26)11(6-9-7-18-8-19-9)21-15(25)10-3-4-13(23)20-10/h7-8,10-12H,1-6H2,(H2,17,24)(H,18,19)(H,20,23)(H,21,25)/t10-,11-,12-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C16H22N6O4
Molecular Weight 362.39
AlogP -1.81
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 4.0
Number of Rotational Bond 6.0
Polar Surface Area 150.28
Molecular species NEUTRAL
Aromatic Rings 1.0
Heavy Atoms 26.0

Pharmacology

Action Mechanism of Action Reference
AGONIST Thyrotropin-releasing hormone receptor agonist PubMed DailyMed
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Membrane receptor Family A G protein-coupled receptor Peptide receptor (family A GPCR) Short peptide receptor (family A GPCR) Neuropeptide receptor
1-3 23-23000 - 10-10 -

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Respiratory Distress Syndrome 3 D012128 ClinicalTrials
Neoplasms 2 D009369 ClinicalTrials

Related Entries

Scaffolds

Cross References

Resources Reference
CAS NUMBER 24305-27-9
ChEBI 35940
ChEMBL CHEMBL1472
DrugBank DB09421
DrugCentral 2316
EPA CompTox DTXSID0023533
FDA SRS 5Y5F15120W
Human Metabolome Database HMDB0060080
Guide to Pharmacology 2139
KEGG C03958
PubChem 638678
SureChEMBL SCHEMBL19825647
ZINC ZINC000004096261
CONTENTS