Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL281872

ZD-4190 FREE BASE
Phase I
Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
Phase I
COc1cc2c(Nc3ccc(Br)cc3F)ncnc2cc1OCCn1ccnn1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL281872
Name ZD-4190 FREE BASE
Phase Phase I
Structure Type MOL
InChI Key YBTGTVGEKMZEQX-UHFFFAOYSA-N
6
Targets
10
Activities
1
Assay Types
5
PK Parameters
20
Publications
0
Known Names

Molecular Properties

459.3
MW (Da)
3.95
ALogP
8
HBA
1
HBD
87.0
PSA (Ų)
0.45
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Chirality Achiral

Extended Properties

Molecular Formula C19H16BrFN6O2
MW 459.28
Aromatic Rings 4
Heavy Atoms 29
NP-Likeness -1.82

Activity Summary

IC50 10 meas. best 7.52

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Vascular endothelial growth factor receptor 2
CHEMBL279
 IC50 7.52 7.52 30.0 2
Epidermal growth factor receptor
CHEMBL203
 IC50 7.3 6.85 50.0 2
Vascular endothelial growth factor receptor
CHEMBL2095227
 IC50 7.3 7.3 50.0 2
Vascular endothelial growth factor receptor 1
CHEMBL1868
 IC50 6.16 6.16 700.0 2
Fibroblast growth factor receptor
CHEMBL2095217
 IC50 5.82 5.82 1500.0 1
Platelet-derived growth factor receptor beta
CHEMBL1913
 IC50 5.47 5.47 3400.0 1

Pharmacokinetic Data

Parameter Value Units Species
CL 8.333 mL.min-1.kg-1 Canis lupus familiaris
F 80.0 % Rattus norvegicus
F 5.0 % Canis lupus familiaris
T1/2 1.3 hr Rattus norvegicus
T1/2 1.1 hr Canis lupus familiaris

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Vascular endothelial growth factor receptor 2 IC50 = 30.0 nM 7.52 Inhibition of vascular endothelial growth factor receptor 2 kinase activity at a... 11881999
Vascular endothelial growth factor receptor 2 IC50 = 30.0 nM 7.52 Vascular endothelial growth factor receptor 2 inhibitory activity at 2 uM of ATP... 10639280
Vascular endothelial growth factor receptor IC50 = 50.0 nM 7.3 Inhibition of human endothelial cell growth stimulate by vascular endothelial gr... 11881999
Epidermal growth factor receptor IC50 = 50.0 nM 7.3 Inhibition of human endothelial cell growth stimulate by endothelial growth fact... 11881999
Vascular endothelial growth factor receptor IC50 = 50.0 nM 7.3 Inhibition of VEGFstimulated HUVEC cell proliferation 10639280
Epidermal growth factor receptor IC50 = 400.0 nM 6.4 Inhibition of epidermal growth factor receptor kinase activity at a concentratio... 11881999
Vascular endothelial growth factor receptor 1 IC50 = 700.0 nM 6.16 Inhibition of fms-like tyrosine kinase receptor (Flt-1) kinase activity at a con... 11881999
Vascular endothelial growth factor receptor 1 IC50 = 700.0 nM 6.16 In vitro vascular endothelial growth factor receptor 1 inhibitory activity at 2 ... 10639280
Fibroblast growth factor receptor IC50 = 1500.0 nM 5.82 Inhibition of FGF-stimulated HUVEC cell proliferation 10639280
Platelet-derived growth factor receptor beta IC50 = 3400.0 nM 5.47 Inhibition of Platelet-derived growth factor receptor beta at ATP <Km 11881999

Literature References

PubMed DOI Target Context # Activities
11881999 10.1021/jm011022e No relevant target 4
11881999 10.1021/jm011022e Rattus norvegicus 3
11881999 10.1021/jm011022e Canis familiaris 3
10639280 10.1021/jm990345w Mus musculus 2
11881999 10.1021/jm011022e Epidermal growth factor receptor 2
11881999 10.1021/jm011022e ADMET 2
11881999 10.1021/jm011022e Angiopoietin-1 receptor 1
10639280 10.1021/jm990345w HUVEC 1
11881999 10.1021/jm011022e Mus musculus 1
11881999 10.1021/jm011022e 3-phosphoinositide-dependent protein kinase 1 1
11881999 10.1021/jm011022e Serine/threonine-protein kinase AKT 1
11881999 10.1021/jm011022e Insulin-like growth factor 1 receptor 1
11881999 10.1021/jm011022e Cyclin-dependent kinase 2 1
11881999 10.1021/jm011022e Dual specificity mitogen-activated protein kinase kinase; MEK1/2 1
11881999 10.1021/jm011022e Receptor tyrosine-protein kinase erbB-2 1
11881999 10.1021/jm011022e Platelet-derived growth factor receptor beta 1
11881999 10.1021/jm011022e Vascular endothelial growth factor receptor 1 1
11881999 10.1021/jm011022e HUVEC 1
11881999 10.1021/jm011022e Vascular endothelial growth factor receptor 1
11881999 10.1021/jm011022e Fibroblast growth factor receptor 1 1

Data from ChEMBL 36 via Core Engine