ASOPRISNIL

Search structure
Synonyms:
Status: Phase 3
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 72W09924WP

Structure
InChI Key GJMNAFGEUJBOCE-MEQIQULJSA-N
Smile COC[C@]1(OC)CC[C@H]2[C@@H]3CCC4=CC(=O)CCC4=C3[C@@H](c3ccc(/C=N/O)cc3)C[C@@]21C
InChI
InChI=1S/C28H35NO4/c1-27-15-24(19-6-4-18(5-7-19)16-29-31)26-22-11-9-21(30)14-20(22)8-10-23(26)25(27)12-13-28(27,33-3)17-32-2/h4-7,14,16,23-25,31H,8-13,15,17H2,1-3H3/b29-16+/t23-,24+,25-,27-,28+/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C28H35NO4
Molecular Weight 449.59
AlogP 5.43
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 5.0
Polar Surface Area 68.12
Molecular species NEUTRAL
Aromatic Rings 1.0
Heavy Atoms 33.0

Pharmacology

Action Mechanism of Action Reference
MODULATOR Progesterone receptor modulator Wikipedia PubMed PubMed
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Transcription factor Nuclear receptor Nuclear hormone receptor subfamily 3 Nuclear hormone receptor subfamily 3 group A Nuclear hormone receptor subfamily 3 group A member 1
- 1900-2000 - - -
Transcription factor Nuclear receptor Nuclear hormone receptor subfamily 3 Nuclear hormone receptor subfamily 3 group C Nuclear hormone receptor subfamily 3 group C member 1
- 85-120 - - -
Transcription factor Nuclear receptor Nuclear hormone receptor subfamily 3 Nuclear hormone receptor subfamily 3 group C Nuclear hormone receptor subfamily 3 group C member 2
- 1600-1600 - - -
Transcription factor Nuclear receptor Nuclear hormone receptor subfamily 3 Nuclear hormone receptor subfamily 3 group C Nuclear hormone receptor subfamily 3 group C member 3
- 0-0 - - -
Transcription factor Nuclear receptor Nuclear hormone receptor subfamily 3 Nuclear hormone receptor subfamily 3 group C Nuclear hormone receptor subfamily 3 group C member 4
- 6-9 - - -

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Leiomyoma 3 D007889 ClinicalTrials
Menorrhagia 3 D008595 ClinicalTrials
Metrorrhagia 3 D008796 ClinicalTrials
Leiomyoma 3 D007889 ClinicalTrials
Endometriosis 2 D004715 ClinicalTrials
Menopause 2 D008593 ClinicalTrials

Related Entries

Scaffolds

Cross References

Resources Reference
CAS NUMBER 199396-76-4
ChEMBL CHEMBL267431
DrugBank DB06680
FDA SRS 72W09924WP
Guide to Pharmacology 2883
PDB AS0
PubChem 9577221
SureChEMBL SCHEMBL58611
ZINC ZINC000003936191
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