EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:138650 - CBL0137

ChEBI IDCHEBI:138650
ChEBI NameCBL0137
Stars
DefinitionA member of the class of carbazoles that is 9H-carbazole which is substituted by acetyl groups at positions 3 and 6, and by a 2-isopropylethyl group on the nitrogen atom (position 9). It is a modulator of histone chaperone FACT (FAcilitates Chromatin Transcription) - interaction of CBL0137 with the FACT complex results in simultaneous NF-κ β suppression, Heat Shock Transcription Factor 1 (HSF1) suppression and p53 activation - and shows antitumour effects in animal models of various cancers.
Last Modified12 October 2017
Submittersabrina, zfin
DownloadsMolfile
FormulaC21H24N2O2
Net Charge0
Average Mass336.435
Monoisotopic Mass336.18378
SMILESCC(=O)c1ccc2c(c1)c1cc(C(C)=O)ccc1n2CCNC(C)C
InChIInChI=1S/C21H24N2O2/c1-13(2)22-9-10-23-20-7-5-16(14(3)24)11-18(20)19-12-17(15(4)25)6-8-21(19)23/h5-8,11-13,22H,9-10H2,1-4H3
InChIKeyJKCSODVERGVDLT-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Roles:
NF-kappaB inhibitor  An inhibitor of NF-κB (nuclear factor κ-light-chain-enhancer of activated B cells), a protein complex involved in the transcription of DNA.
apoptosis inducer  Any substance that induces the process of apoptosis (programmed cell death) in multi-celled organisms.
p53 activator  Any activator of tumour protein p53.
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
CBL0137 (CHEBI:138650) has role antineoplastic agent (CHEBI:35610)
CBL0137 (CHEBI:138650) has role apoptosis inducer (CHEBI:68495)
CBL0137 (CHEBI:138650) has role NF-κB inhibitor (CHEBI:73240)
CBL0137 (CHEBI:138650) has role p53 activator (CHEBI:77731)
CBL0137 (CHEBI:138650) is a aromatic ketone (CHEBI:76224)
CBL0137 (CHEBI:138650) is a carbazoles (CHEBI:48513)
CBL0137 (CHEBI:138650) is a methyl ketone (CHEBI:51867)
CBL0137 (CHEBI:138650) is a secondary amino compound (CHEBI:50995)
CBL0137 (CHEBI:138650) is a tertiary amino compound (CHEBI:50996)
IUPAC Name 
1,1'-{9-[2-(isopropylamino)ethyl]-9H-carbazole-3,6-diyl}diethanone
Synonyms  Source
CBLC137SUBMITTER
Curaxin 137SUBMITTER
1,1'-{9-[2-(propan-2-ylamino)ethyl]-9H-carbazole-3,6-diyl}diethanoneIUPAC
CBL-0137 free baseChemIDplus
3,6-diacetyl-9-(2-isopropylethyl)-9H-carbazoleChEBI
Curaxin-137ChEBI
Manual XrefsDatabases
WO2013148864Patent
Registry NumbersSources
Reaxys:24576552Reaxys
CAS:1197996-80-7ChemIDplus
Citations