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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:133397 - Ki11502
Main
ChEBI Ontology
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ChEBI Name
Ki11502
ChEBI ID
CHEBI:133397
Definition
A member of the class of quinolines that acts as a receptor tyrosine kinase inhibitor and apoptosis inducer with potential for use in treatment of leukemia and colorectal cancer.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
TheOtherDave
Supplier Information
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Formula
C26H23N3O4S
Net Charge
0
Average Mass
473.546
Monoisotopic Mass
473.14093
InChI
InChI=1S/C26H23N3O4S/c1-
16-
6-
4-
5-
7-
19(16)
25(30)
29-
26(34)
28-
17-
8-
10-
18(11-
9-
17)
33-
22-
12-
13-
27-
21-
15-
24(32-
3)
23(31-
2)
14-
20(21)
22/h4-
15H,1-
3H3,(H2,28,29,30,34)
InChIKey
ZXGIBSBJQLLUEE-UHFFFAOYSA-N
SMILES
C=1C=CC(=C(C1)C(=O)NC(=S)NC=2C=CC(=CC2)OC=3C=4C=C(C(=CC4N=CC3)OC)OC)C
Roles Classification
Biological Role
(s):
EC 2.7.10.1 (receptor protein-tyrosine kinase) inhibitor
An EC 2.7.10.* (protein-tyrosine kinase) inhibitor that interferes with the action of receptor protein-tyrosine kinase (EC 2.7.10.1).
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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
Ki11502 (
CHEBI:133397
)
has role
antineoplastic agent (
CHEBI:35610
)
Ki11502 (
CHEBI:133397
)
has role
apoptosis inducer (
CHEBI:68495
)
Ki11502 (
CHEBI:133397
)
has role
EC 2.7.10.1 (receptor protein-tyrosine kinase) inhibitor (
CHEBI:62434
)
Ki11502 (
CHEBI:133397
)
is a
aromatic ether (
CHEBI:35618
)
Ki11502 (
CHEBI:133397
)
is a
benzamides (
CHEBI:22702
)
Ki11502 (
CHEBI:133397
)
is a
quinolines (
CHEBI:26513
)
Ki11502 (
CHEBI:133397
)
is a
thioureas (
CHEBI:51276
)
IUPAC Name
N
-({4-[(6,7-dimethoxyquinolin-4-yl)oxy]phenyl}carbamothioyl)-2-methylbenzamide
Synonyms
Sources
N
-(4-((6,7-dimethoxy-4-quinoyl)oxy)phenyl)-
N
'-(2-methylbenzoyl)thiourea
SUBMITTER
PDGFR tyrosine kinase inhibitor V
SUBMITTER
Registry Numbers
Types
Sources
10488231
Reaxys Registry Number
Reaxys
347155-76-4
CAS Registry Number
SUBMITTER
Citations
Types
Sources
18309036
PubMed citation
Europe PMC
19818754
PubMed citation
Europe PMC
20610572
PubMed citation
Europe PMC
22683649
PubMed citation
Europe PMC
23900414
PubMed citation
Europe PMC
24462709
PubMed citation
Europe PMC
Last Modified
03 November 2016