Sanofi-14h   Click here for help

GtoPdb Ligand ID: 13067

Synonyms: compound 14h [PMID: 25589934]
Immunopharmacology Ligand
Compound class: Synthetic organic
Comment: Sanofi-14h is a small molecule inhibitor of AGC family kinases such as the serum/glucocorticoid regulated kinases (SGKs) 1 and 3 [3]. It has also been reported to inhibit STING-mediated TANK binding kinase 1 (TBK1) activation independently of SGK1/3 inhibition [2]. This latter report showed that when STING was activated in macrophages, Sanofi-14h inhibited IFNβ production. Functionally Sanofi-14h's mechanism of action included inhibition of SGK activity in conjunction with disruption of the TBK1/IRF3 pathway downstream of STING activation.
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 8
Hydrogen bond donors 3
Rotatable bonds 4
Topological polar surface area 129.68
Molecular weight 435.29
XLogP 1.03
No. Lipinski's rules broken 0
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Canonical SMILES C1=CC(=CC=C1C2=CN=C3C(=NNC3=N2)N)NS(=O)(=O)C4=CC(=CC=C4Cl)Cl
Isomeric SMILES NC1=NNC2=C1N=CC(=N2)C3=CC=C(NS(=O)(=O)C4=CC(Cl)=CC=C4Cl)C=C3
InChI InChI=1S/C17H12Cl2N6O2S/c18-10-3-6-12(19)14(7-10)28(26,27)25-11-4-1-9(2-5-11)13-8-21-15-16(20)23-24-17(15)22-13/h1-8,25H,(H3,20,22,23,24)
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
Synonyms Click here for help
compound 14h [PMID: 25589934]
Database Links Click here for help
BindingDB Ligand 50443635
CAS Registry No. 1426214-64-3 (source: PubChem)
ChEMBL Ligand CHEMBL3092461
GtoPdb PubChem SID 491299849
PubChem CID 71537261
Search Google for chemical match using the InChIKey RTERCHJCWXQPSS-UHFFFAOYSA-N
Search Google for chemicals with the same backbone RTERCHJCWXQPSS
UniChem Compound Search for chemical match using the InChIKey RTERCHJCWXQPSS-UHFFFAOYSA-N
UniChem Connectivity Search for chemical match using the InChIKey RTERCHJCWXQPSS-UHFFFAOYSA-N