CHEBI:137064 - LY-2157299

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ChEBI Name LY-2157299
ChEBI ID CHEBI:137064
Definition A pyrrolopyrazole that is 5,6-dihydro-4H-pyrrolo[1,2-b]pyrazole which is substituted at positions 2 and 3 by 6-methylpyridin-2-yl and 6-(aminocarbonyl)quinolin-4-yl groups, respectively. A Transforming growth factor-βRI (TGF-βRI) kinase inhibitor, it blocks TGF-β-mediated tumor growth in glioblastoma.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Sabrina Toro
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Formula C22H19N5O
Net Charge 0
Average Mass 369.420
Monoisotopic Mass 369.159
InChI InChI=1S/C22H19N5O/c1-13-4-2-5-18(25-13)21-20(19-6-3-11-27(19)26-21)15-9-10-24-17-8-7-14(22(23)28)12-16(15)17/h2,4-5,7-10,12H,3,6,11H2,1H3,(H2,23,28)
InChIKey IVRXNBXKWIJUQB-UHFFFAOYSA-N
SMILES C12=C(C=CN=C1C=CC(=C2)C(N)=O)C=3C(=NN4C3CCC4)C=5N=C(C=CC5)C
Roles Classification
Biological Role(s): TGFbeta receptor antagonist
An antagonist that binds to and deactivates TGFbeta receptors.
Application(s): antineoplastic agent
A substance that inhibits or prevents the proliferation of neoplasms.
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ChEBI Ontology
Outgoing LY-2157299 (CHEBI:137064) has role antineoplastic agent (CHEBI:35610)
LY-2157299 (CHEBI:137064) has role TGFβ receptor antagonist (CHEBI:91202)
LY-2157299 (CHEBI:137064) is a aromatic amide (CHEBI:62733)
LY-2157299 (CHEBI:137064) is a methylpyridines (CHEBI:25340)
LY-2157299 (CHEBI:137064) is a monocarboxylic acid amide (CHEBI:29347)
LY-2157299 (CHEBI:137064) is a pyrrolopyrazole (CHEBI:46866)
LY-2157299 (CHEBI:137064) is a quinolines (CHEBI:26513)
IUPAC Name
4-[2-(6-methylpyridin-2-yl)-5,6-dihydro-4H-pyrrolo[1,2-b]pyrazol-3-yl]quinoline-6-carboxamide
INNs Sources
galunisertib WHO MedNet
galunisertib WHO MedNet
galunisertib WHO MedNet
galunisertibum WHO MedNet
Synonyms Sources
LY 2157299 SUBMITTER
LY2157299 SUBMITTER
Manual Xrefs Databases
D10437 KEGG DRUG
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Registry Numbers Types Sources
14275134 Reaxys Registry Number Reaxys
700874-72-2 CAS Registry Number KEGG DRUG
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Last Modified
01 June 2017