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Details

Stereochemistry ACHIRAL
Molecular Formula C26H28N6O.ClH
Molecular Weight 477.001
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NEMIRALISIB HYDROCHLORIDE

SMILES

Cl.CC(C)N1CCN(CC2=CN=C(O2)C3=CC(=CC4=C3C=NN4)C5=CC=CC6=C5C=CN6)CC1

InChI

InChIKey=GECUEJGEJLAXQA-UHFFFAOYSA-N
InChI=1S/C26H28N6O.ClH/c1-17(2)32-10-8-31(9-11-32)16-19-14-28-26(33-19)22-12-18(13-25-23(22)15-29-30-25)20-4-3-5-24-21(20)6-7-27-24;/h3-7,12-15,17,27H,8-11,16H2,1-2H3,(H,29,30);1H

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C26H28N6O
Molecular Weight 440.5401
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

GSK-2269557 (nemiralisib), a PI3Kδ inhibitor, is in development as an anti-inflammatory drug for the treatment of inflammatory airways disease. Studies in moderate or severe stable COPD patients have shown an acceptable safety and tolerability profile when GSK-2269557 was administered via inhalation. Cough was the most commonly reported adverse event.

Approval Year

Targets

Targets

Primary TargetPharmacologyConditionPotency
9.9 null [pKi]
Substance Class Chemical
Created
by admin
on Sat Dec 16 11:51:28 GMT 2023
Edited
by admin
on Sat Dec 16 11:51:28 GMT 2023
Record UNII
II4WQU7U3O
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NEMIRALISIB HYDROCHLORIDE
Common Name English
2-(6-(1H-INDOL-4-YL)-1H-INDAZOL-4-YL)-5-((4-ISOPROPYLPIPERAZIN-1-YL)METHYL)OXAZOLE HYDROCHLORIDE
Systematic Name English
GSK-2269557
Code English
1H-INDAZOLE, 6-(1H-INDOL-4-YL)-4-(5-((4-(1-METHYLETHYL)-1-PIPERAZINYL)METHYL)-2-OXAZOLYL)-, HYDROCHLORIDE (1:1)
Systematic Name English
GSK2269557
Code English
Code System Code Type Description
CAS
1254036-77-5
Created by admin on Sat Dec 16 11:51:28 GMT 2023 , Edited by admin on Sat Dec 16 11:51:28 GMT 2023
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MANUFACTURER PRODUCT INFORMATION
GSK-2269557
Created by admin on Sat Dec 16 11:51:28 GMT 2023 , Edited by admin on Sat Dec 16 11:51:28 GMT 2023
PRIMARY MedKoo CAT NO: 522375CAS NO: 1254036-77-5(HCl salt), 1254036-71-9(free base)Description: GSK-2269557 is a potent and selective PI3K.DELTA. inhibitor. GSK-2269557 is is currently in clinical trials for the treatment of respiratory diseases such as asthma and COPD. GSK-2269557 is highly selective for PI3K.DELTA. over the closely related isoforms and are active in a disease relevant brown Norway rat acute OVA model of Th2-driven lung inflammation. PI3K.DELTA. is highly enriched in leukocytes, making it an attractive target for the treatment of inflammatory conditions, such as asthma,6 chronic obstructive pulmonary disease (COPD), and autoimmune diseases. (last updated: 9/3/2015).
ChEMBL
CHEMBL3545250
Created by admin on Sat Dec 16 11:51:28 GMT 2023 , Edited by admin on Sat Dec 16 11:51:28 GMT 2023
PRIMARY
SMS_ID
100000175665
Created by admin on Sat Dec 16 11:51:28 GMT 2023 , Edited by admin on Sat Dec 16 11:51:28 GMT 2023
PRIMARY
FDA UNII
II4WQU7U3O
Created by admin on Sat Dec 16 11:51:28 GMT 2023 , Edited by admin on Sat Dec 16 11:51:28 GMT 2023
PRIMARY
PUBCHEM
49784084
Created by admin on Sat Dec 16 11:51:28 GMT 2023 , Edited by admin on Sat Dec 16 11:51:28 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY
Drug: GSK 2269557(Primary); Indication: Asthma; Focus: Therapeutic Use; Sponsor: GlaxoSmithKline; Most Recent Events: 25 Mar 2016 Last checked against European Clinical Trials Database record, 01 Dec 2015 Status changed from not yet recruiting to recruiting as reported by ClinicalTrials.gov, 05 Aug 2015 New trial record