CHEBI:230540 - MK-2461

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ChEBI Name MK-2461
ChEBI ID CHEBI:230540
Definition A member of the class of benzocycloheptapyridines that is 5H-benzo[4,5]cyclohepta[1,2-b]pyridin-5-one substituted by 1-methyl-1H-pyrazol-4-yl and [{[(2R)-1,4-dioxan-2-yl]methyl}(methyl)sulfamoyl]amino groups at positions 3 and 7, respectively. It is a novel ATP-competitive multi-targeted inhibitor of activated c-Met (IC50 = 2.5 nM).
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Jonathan Muyskens
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Formula C24H25N5O5S
Net Charge 0
Average Mass 495.550
Monoisotopic Mass 495.15764
InChI InChI=1S/C24H25N5O5S/c1-28-13-18(12-26-28)17-9-22-23(25-11-17)6-4-16-3-5-19(10-21(16)24(22)30)27-35(31,32)29(2)14-20-15-33-7-8-34-20/h3-6,9-13,20,27H,7-8,14-15H2,1-2H3/t20-/m1/s1
InChIKey JGEBLDKNWBUGRZ-HXUWFJFHSA-N
SMILES CN(C[C@@H]1COCCO1)S(=O)(=O)NC1=CC2=C(C=C1)C=CC1=C(C=C(C=N1)C1=CN(C)N=C1)C2=O
Roles Classification
Biological Role(s): c-Met tyrosine kinase inhibitor
An EC 2.7.10.1 (receptor protein-tyrosine kinase) inhibitor that interferes with the action of c-Met tyrosine kinase.
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 MK-2461 (CHEBI:230540) has role antineoplastic agent (CHEBI:35610)
MK-2461 (CHEBI:230540) has role apoptosis inducer (CHEBI:68495)
MK-2461 (CHEBI:230540) has role c-Met tyrosine kinase inhibitor (CHEBI:90199)
MK-2461 (CHEBI:230540) is a benzocycloheptapyridine (CHEBI:48593)
MK-2461 (CHEBI:230540) is a dioxanes (CHEBI:46926)
MK-2461 (CHEBI:230540) is a pyrazoles (CHEBI:26410)
MK-2461 (CHEBI:230540) is a sulfamides (CHEBI:51871)
IUPAC Name
N-[(2R)-1,4-dioxan-2-ylmethyl]-N-methyl-N'-[3-(1-methyl-1H-pyrazol-4-yl)-5-oxo-5H-benzo[4,5]cyclohepta[1,2-b]pyridin-7-yl]sulfuric diamide
Synonyms Sources
9-[[[(2R)-1,4-dioxan-2-yl]methyl-methylsulfamoyl]amino]-2-(1-methylpyrazol-4-yl)-11-oxobenzo[1,2]cyclohepta[2,4-b]pyridine SUBMITTER
MK 2461 ChEBI
MK2461 SUBMITTER
Registry Number Type Source
917879-39-1 CAS Registry Number SUBMITTER
Citations Waiting for Citations Types Sources
19357798 PubMed citation Europe PMC
20145145 PubMed citation Europe PMC
20836672 PubMed citation Europe PMC
21247903 PubMed citation Europe PMC
21429632 PubMed citation Europe PMC
21608528 PubMed citation Europe PMC
25806189 PubMed citation Europe PMC
26077488 PubMed citation Europe PMC
26863403 PubMed citation Europe PMC
28196027 PubMed citation Europe PMC
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Last Modified
08 May 2024