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Compound Detail

CHEMBL3893950

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COc1cc(OC)cc(N(CCNC[Si](C)(C)C)c2ccc3ncc(-c4cnn(C)c4)nc3c2)c1.Cl

Basic Information

ChEMBL ID CHEMBL3893950
Phase Preclinical
Structure Type MOL
InChI Key JMKXJKVYUUVONH-UHFFFAOYSA-N
Parent Compound CHEMBL3990499
Active Moiety CHEMBL3990499
6
Targets
10
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

490.7
MW (Da)

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H35ClN6O2Si
MW 527.15

Activity Summary

IC50 10 meas. best 8.32

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Fibroblast growth factor receptor 2
CHEMBL4142
IC50 8.32 8.32 4.8 1
Fibroblast growth factor receptor 3
CHEMBL2742
IC50 8.22 7.645 6.0 2
Fibroblast growth factor receptor 1
CHEMBL3650
IC50 8.14 7.64 7.2 2
Fibroblast growth factor receptor 4
CHEMBL3973
IC50 7.89 7.89 12.9 1
Vascular endothelial growth factor receptor 2
CHEMBL279
IC50 7.2 6.08 63.1 3
Receptor-type tyrosine-protein kinase FLT3
CHEMBL1974
IC50 5.15 5.15 7079.5 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Fibroblast growth factor receptor 2 IC50 = 4.786 nM 8.32 Inhibition of human FGFR2 using Btn-Flt3 as substrate after 60 mins by TR-FRET a... -
Fibroblast growth factor receptor 3 IC50 = 6.026 nM 8.22 Inhibition of human FGFR3 using Btn-Flt3 as substrate after 60 mins by TR-FRET a... -
Fibroblast growth factor receptor 1 IC50 = 7.244 nM 8.14 Inhibition of human FGFR1 using Btn-Flt3 as substrate after 60 mins by TR-FRET a... -
Fibroblast growth factor receptor 4 IC50 = 12.88 nM 7.89 Inhibition of human FGFR4 using Btn-Flt3 as substrate after 60 mins by TR-FRET a... -
Vascular endothelial growth factor receptor 2 IC50 = 63.1 nM 7.2 Inhibition of human VEGFR2 using Btn-Flt3 as substrate after 120 mins by TR-FRET... -
Fibroblast growth factor receptor 1 IC50 = 72.44 nM 7.14 Inhibition of FGFR1 (unknown origin) transfected in mouse BA/F3 cells assessed a... -
Fibroblast growth factor receptor 3 IC50 = 85.11 nM 7.07 Inhibition of FGFR3 (unknown origin) transfected in mouse BA/F3 cells assessed a... -
Vascular endothelial growth factor receptor 2 IC50 = 1000.0 nM 6.0 Inhibition of VEGFR2 (unknown origin) transfected in mouse BA/F3 cells assessed ... -
Receptor-type tyrosine-protein kinase FLT3 IC50 = 7079.46 nM 5.15 Inhibition of FLT3 (unknown origin) transfected in mouse BA/F3 cells assessed as... -
Vascular endothelial growth factor receptor 2 IC50 = 9120.11 nM 5.04 Inhibition of VEGFR2 (unknown origin) transfected in mouse BA/F3 cells assessed ... -

Data from ChEMBL 36 via Core Engine