LEUPROLIDE

Search structure
Synonyms:
Status: Approved (1985)
Entry Type: Protein
Molecule Category: Parent
UNII: EFY6W0M8TG

Structure
InChI Key GFIJNRVAKGFPGQ-LIJARHBVSA-N
Smile CCNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@@H]1CCC(=O)N1
InChI
InChI=1S/C59H84N16O12/c1-6-63-57(86)48-14-10-22-75(48)58(87)41(13-9-21-64-59(60)61)68-51(80)42(23-32(2)3)69-52(81)43(24-33(4)5)70-53(82)44(25-34-15-17-37(77)18-16-34)71-56(85)47(30-76)74-54(83)45(26-35-28-65-39-12-8-7-11-38(35)39)72-55(84)46(27-36-29-62-31-66-36)73-50(79)40-19-20-49(78)67-40/h7-8,11-12,15-18,28-29,31-33,40-48,65,76-77H,6,9-10,13-14,19-27,30H2,1-5H3,(H,62,66)(H,63,86)(H,67,78)(H,68,80)(H,69,81)(H,70,82)(H,71,85)(H,72,84)(H,73,79)(H,74,83)(H4,60,61,64)/t40-,41-,42-,43+,44-,45-,46-,47-,48-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C59H84N16O12
Molecular Weight 1209.42
AlogP None
Hydrogen Bond Acceptor None
Hydrogen Bond Donor None
Number of Rotational Bond None
Polar Surface Area None
Molecular species None
Aromatic Rings None
Heavy Atoms None

Pharmacology

Primary Target
GnRH1 receptor
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) GnRH receptor
- 0-1 - - -

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Infertility 3 D007246 ClinicalTrials
Prostatic Neoplasms 3 D011471 ClinicalTrials
Prostatic Neoplasms 3 D011471 ClinicalTrials
Prostatic Neoplasms 3 D011471 ClinicalTrials
Leiomyoma 3 D007889 ClinicalTrials
Myoma 3 D009214 ClinicalTrials
Breast Neoplasms 3 D001943 ClinicalTrials
Prostatic Neoplasms, Castration-Resistant 3 D064129 ClinicalTrials
Pain 3 D010146 ClinicalTrials
Endometriosis 3 D004715 ClinicalTrials
Melanoma 2 D008545 ClinicalTrials
Hypogonadism 2 D007006 ClinicalTrials
Hyperandrogenism 2 D017588 ClinicalTrials
Obesity 1 D009765 ClinicalTrials
HIV Infections 1 D015658 ClinicalTrials
Menopause 1 D008593 ClinicalTrials

Related Entries

Scaffolds

Salt
Salt

Cross References

Resources Reference
CAS NUMBER 53714-56-0
ChEBI 6427
ChEMBL CHEMBL1201199
DrugBank DB00007
DrugCentral 1559
EPA CompTox DTXSID50872411
FDA SRS EFY6W0M8TG
Human Metabolome Database HMDB0041916
Guide to Pharmacology 1175
PubChem 657181
SureChEMBL SCHEMBL4585
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