XMD-12 - Moligand™,≥98% , Inhibitor of aurora kinase A;Inhibitor of aurora kinase B;Inhibitor of leucine rich repeat kinase 2, CAS No.1234481-08-3, Inhibitor of aurora kinase A;Inhibitor of aurora kinase B;Inhibitor of leucine rich repeat kinase 2

CAS: 1234481-08-3 Cat. No.: X614900 Fórmula: C₂₄H₂₆N₆O₂ Peso molecular: 430.50

GRADE & PURITY Moligand™, ≥98%

Synonyms

Aurora kinase-IN-5

Storage

Store at -20°C,Argon charged

Shipped In

Ice chest + Ice pads

Visão geral

XMD-12is an Aurora kinase (Aurora Kinase) inhibitor with anti-tumor activity that promotes paclitaxelinduced cell death. XMD-12 exhibits high selectivity and potency against Aurora A, B, and C kinases, with IC50 values of 5.6, 18.4, and 24.6 nM, respectively.

Specifications

Sinónimos

Aurora kinase-IN-5

Especificações e pureza

Moligand™,≥98%

Condições de armazenamento de armazenamento

Store at -20°C,Argon charged

Enviado em

Ice chest + Ice pads

Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.

Grau

Moligand™

Tipo de ação

INHIBITOR

Mecanismo de ação

Inhibitor of aurora kinase A;Inhibitor of aurora kinase B;Inhibitor of leucine rich repeat kinase 2

Pureza

≥98%

Nomes e identificadores

• Pubchem Sid: 528768502
• Sorrisos canónicos: Cn1c2ccccc2c(=O)n(c2cnc(nc12)Nc1ccc(cc1)N1CCC(CC1)O)C
• IUPAC Name: 2-[4-(4-hydroxypiperidin-1-yl)anilino]-5,11-dimethylpyrimido[4,5-b][1,4]benzodiazepin-6-one
• InChIKey: DFQAJLQXPSPNJE-UHFFFAOYSA-N
• INCHI: 1S/C24H26N6O2/c1-28-20-6-4-3-5-19(20)23(32)29(2)21-15-25-24(27-22(21)28)26-16-7-9-17(10-8-16)30-13-11-18(31)12-14-30/h3-10,15,18,31H,11-14H2,1-2H3,(H,25,26,27)
• Peso molecular: 430.50

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Piperidines
      • Subclass Phenylpiperidines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Piperidines
• Subclass: Phenylpiperidines
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenylpiperidines
• Alternative Parents: Alkyldiarylamines Pyrimidodiazepines 1,4-benzodiazepines Dialkylarylamines Aniline and substituted anilines 1,4-diazepines Aminopyrimidines and derivatives Imidolactams Vinylogous amides Tertiary carboxylic acid amides Heteroaromatic compounds Secondary alcohols Lactams Amino acids and derivatives Secondary amines Azacyclic compounds Hydrocarbon derivatives Organic oxides Organopnictogen compounds
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Alkyldiarylamine - Phenylpiperidine - Pyrimidodiazepine - 1,4-benzodiazepine - Benzodiazepine - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Aminopyrimidine - Para-diazepine - Imidolactam - Benzenoid - Monocyclic benzene moiety - Pyrimidine - Tertiary carboxylic acid amide - Vinylogous amide - Heteroaromatic compound - Amino acid or derivatives - Carboxamide group - Lactam - Tertiary amine - Secondary alcohol - Carboxylic acid derivative - Azacycle - Secondary amine - Organooxygen compound - Organonitrogen compound - Amine - Alcohol - Organic oxide - Organopnictogen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
• Descrição: This compound belongs to the class of organic compounds known as phenylpiperidines. These are compounds containing a phenylpiperidine skeleton, which consists of a piperidine bound to a phenyl group.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Alvos associados (humanos)

LRRK2 Tchem Leucine-rich repeat serine/threonine-protein kinase 2 (0 Activities)

Discover Target: LRRK2

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

AURKA Tchem Aurora kinase A (0 Activities)

Discover Target: AURKA

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

AURKB Tchem Aurora kinase B (0 Activities)

Discover Target: AURKB

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

MAPK7 Tchem Mitogen-activated protein kinase 7 (929 Activities)

Discover Target: MAPK7

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

DCLK1 Tchem Serine/threonine-protein kinase DCLK1 (1025 Activities)

Discover Target: DCLK1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mecanismos de ação