CHEBI:173077 - copanlisib

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ChEBI Name copanlisib
ChEBI ID CHEBI:173077
Definition An imidazoquinazoline that is 2,3-dihydroimidazo[1,2-c]quinazoline substituted by (2-aminopyrimidine-5-carbonyl)amino, methoxy, and 3-(morpholin-4-yl)propoxy groups at positions 5, 7 and 8, respectively. It is a intravenous pan-class I PI3K inhibitor used for the treatment of relapsed follicular lymphoma in patients who have received at least 2 prior systemic therapies.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter R. Stephan
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Formula C23H28N8O4
Net Charge 0
Average Mass 480.529
Monoisotopic Mass 480.22335
InChI InChI=1S/C23H28N8O4/c1-33-19-17(35-10-2-6-30-8-11-34-12-9-30)4-3-16-18(19)28-23(31-7-5-25-20(16)31)29-21(32)15-13-26-22(24)27-14-15/h3-4,13-14H,2,5-12H2,1H3,(H2,24,26,27)(H,28,29,32)
InChIKey PZBCKZWLPGJMAO-UHFFFAOYSA-N
SMILES COC1=C(OCCCN2CCOCC2)C=CC2=C1N=C(NC(=O)C1=CN=C(N)N=C1)N1CCN=C21
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Biological Role(s): EC 2.7.1.137 (phosphatidylinositol 3-kinase) inhibitor
An inhibitor of phosphatidylinositol 3-kinase, EC 2.7.1.137, a family of related enzymes capable of phosphorylating the 3 position hydroxy group of the inositol ring of a phosphatidylinositol.
apoptosis inducer
Any substance that induces the process of apoptosis (programmed cell death) in multi-celled organisms.
Application(s): antineoplastic agent
A substance that inhibits or prevents the proliferation of neoplasms.
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ChEBI Ontology
Outgoing copanlisib (CHEBI:173077) has role antineoplastic agent (CHEBI:35610)
copanlisib (CHEBI:173077) has role apoptosis inducer (CHEBI:68495)
copanlisib (CHEBI:173077) has role EC 2.7.1.137 (phosphatidylinositol 3-kinase) inhibitor (CHEBI:50914)
copanlisib (CHEBI:173077) is a aminopyrimidine (CHEBI:38338)
copanlisib (CHEBI:173077) is a aromatic ether (CHEBI:35618)
copanlisib (CHEBI:173077) is a diether (CHEBI:46786)
copanlisib (CHEBI:173077) is a imidazoquinazoline (CHEBI:47975)
copanlisib (CHEBI:173077) is a morpholines (CHEBI:38785)
copanlisib (CHEBI:173077) is a pyrimidinecarboxamide (CHEBI:48438)
copanlisib (CHEBI:173077) is a secondary carboxamide (CHEBI:140325)
copanlisib (CHEBI:173077) is a tertiary amino compound (CHEBI:50996)
Incoming copanlisib dihydrochloride (CHEBI:173081) has part copanlisib (CHEBI:173077)
IUPAC Name
2-amino-N-{7-methoxy-8-[3-(morpholin-4-yl)propoxy]-2,3-dihydroimidazo[1,2-c]quinazolin-5-yl}pyrimidine-5-carboxamide
INNs Sources
copanlisib WHO MedNet
copanlisib WHO MedNet
copanlisib WHO MedNet
copanlisibum WHO MedNet
Synonyms Sources
BAY 80-6946 ChemIDplus
BAY-80-6946 DrugBank
BAY80-6946 DrugBank
Manual Xrefs Databases
25069683 ChemSpider
5256 DrugCentral
6E2 PDBeChem
Copanlisib Wikipedia
D10867 KEGG DRUG
DB12483 DrugBank
View more database links
Registry Number Type Source
1032568-63-0 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
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Last Modified
25 May 2021