Compound Detail

CHEMBL1967878

CENISERTIB

🧪 Phase II

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🧪 Phase II

Cc1cc(Nc2ncc(F)c(NC3C4C=CC(C4)C3C(N)=O)n2)ccc1N1CCN(C)CC1

ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID	CHEMBL1967878
Name	CENISERTIB
Phase	Phase II
Structure Type	MOL
InChI Key	KSOVGRCOLZZTPF-UHFFFAOYSA-N

Known Names

AS 703569 As-703569 As703569 Aurora kinase inhibitor as703569 Cenisertib R 763 R-763

113

Targets

114

Activities

Assay Types

PK Parameters

Publications

Known Names

Indications

Mechanisms

Molecular Properties

451.6

MW (Da)

2.51

ALogP

HBA

HBD

99.4

PSA (Å²)

0.58

QED

Ro5 Violations

Rot. Bonds

Drug Information

Molecule Type	Small molecule
Chirality	Racemic

USAN Stem

-sertib

Extended Properties

Molecular Formula	C24H30FN7O
MW	451.55
Aromatic Rings	2
Heavy Atoms	33
NP-Likeness	-1.25

Mechanism of Action

Mechanism	Action Type	Target	Direct	Efficacy
Serine/threonine-protein kinase Aurora inhibitor	INHIBITOR	Serine/threonine-protein kinase Aurora	✓	✓

Indications

Hematologic Neoplasms Neoplasms

Activity Summary

Ki 114 meas. best 9.2

Target Activity Profile

Target	Type	Best pChEMBL	Mean pChEMBL	Best (nM)	# Data
Leucine-rich repeat serine/threonine-protein kinase 2 CHEMBL1075104	Ki	9.2	9.2	0.6	1
5'-AMP-activated protein kinase catalytic subunit alpha-1 CHEMBL4045	Ki	9.0	9.0	1.0	1
Proto-oncogene tyrosine-protein kinase receptor Ret CHEMBL2041	Ki	8.9	8.9	1.3	1
Serine/threonine-protein kinase Chk2 CHEMBL2527	Ki	8.6	8.6	2.5	1
Proto-oncogene tyrosine-protein kinase ROS CHEMBL5568	Ki	8.6	8.6	2.5	1
Platelet-derived growth factor receptor beta CHEMBL1913	Ki	8.4	8.4	4.0	1
Macrophage-stimulating protein receptor CHEMBL2689	Ki	8.4	8.4	4.0	1
Aurora kinase A CHEMBL4722	Ki	8.4	8.4	4.0	1
Vascular endothelial growth factor receptor 3 CHEMBL1955	Ki	8.3	8.3	5.0	1
Mitogen-activated protein kinase kinase kinase kinase 2 CHEMBL5330	Ki	8.3	8.3	5.0	1
Tyrosine-protein kinase Lck CHEMBL258	Ki	8.2	8.2	6.3	1
Non-receptor tyrosine-protein kinase TYK2 CHEMBL3553	Ki	8.2	8.2	6.3	1
Serine/threonine-protein kinase PLK4 CHEMBL3788	Ki	8.2	8.2	6.3	1
Tyrosine-protein kinase Fyn CHEMBL1841	Ki	8.1	8.1	7.9	1
Vascular endothelial growth factor receptor 1 CHEMBL1868	Ki	8.1	8.1	7.9	1
Tyrosine-protein kinase Blk CHEMBL2250	Ki	8.1	8.1	7.9	1
Vascular endothelial growth factor receptor 2 CHEMBL279	Ki	8.1	8.1	7.9	1
Receptor tyrosine-protein kinase erbB-4 CHEMBL3009	Ki	8.1	8.1	7.9	1
Fibroblast growth factor receptor 1 CHEMBL3650	Ki	8.1	8.1	7.9	1
Serine/threonine-protein kinase 17A CHEMBL4525	Ki	8.1	8.1	7.9	1
Platelet-derived growth factor receptor alpha CHEMBL2007	Ki	8.0	8.0	10.0	1
Proto-oncogene tyrosine-protein kinase Src CHEMBL267	Ki	8.0	8.0	10.0	1
Tyrosine-protein kinase JAK2 CHEMBL2971	Ki	8.0	8.0	10.0	1
Interleukin-1 receptor-associated kinase 1 CHEMBL3357	Ki	8.0	8.0	10.0	1
ALK tyrosine kinase receptor CHEMBL4247	Ki	8.0	7.5	10.0	2
Mitogen-activated protein kinase kinase kinase kinase 5 CHEMBL4852	Ki	8.0	8.0	10.0	1
Tyrosine-protein kinase Lyn CHEMBL3905	Ki	7.9	7.9	12.6	1
Serine/threonine-protein kinase 3 CHEMBL4708	Ki	7.9	7.9	12.6	1
MAP/microtubule affinity-regulating kinase 3 CHEMBL5600	Ki	7.9	7.9	12.6	1
LIM domain kinase 1 CHEMBL3836	Ki	7.8	7.8	15.8	1
Leukocyte tyrosine kinase receptor CHEMBL5627	Ki	7.8	7.8	15.8	1
Serine/threonine-protein kinase BRSK1 CHEMBL5650	Ki	7.8	7.8	15.8	1
Fibroblast growth factor receptor 3 CHEMBL2742	Ki	7.7	7.7	19.9	1
Tyrosine-protein kinase ITK/TSK CHEMBL2959	Ki	7.6	7.6	25.1	1
Activated CDC42 kinase 1 CHEMBL4599	Ki	7.6	7.6	25.1	1
Tyrosine-protein kinase receptor UFO CHEMBL4895	Ki	7.6	7.6	25.1	1
Tyrosine-protein kinase BTK CHEMBL5251	Ki	7.6	7.6	25.1	1
Mitogen-activated protein kinase 8 CHEMBL2276	Ki	7.5	7.5	31.6	1
Serine/threonine-protein kinase D2 CHEMBL4900	Ki	7.5	7.5	31.6	1
Tyrosine-protein kinase ABL1 CHEMBL1862	Ki	7.4	7.4	39.8	1
Rho-associated protein kinase 2 CHEMBL2973	Ki	7.4	7.4	39.8	1
Misshapen-like kinase 1 CHEMBL5518	Ki	7.4	7.4	39.8	1
Activin receptor type-1 CHEMBL5903	Ki	7.4	7.4	39.8	1
Tyrosine-protein kinase JAK3 CHEMBL2148	Ki	7.3	7.3	50.1	1
Serine/threonine-protein kinase D3 CHEMBL2595	Ki	7.3	7.3	50.1	1
Serine/threonine-protein kinase N2 CHEMBL3032	Ki	7.3	7.3	50.1	1
Rho-associated protein kinase 1 CHEMBL3231	Ki	7.3	7.3	50.1	1
Dual specificity mitogen-activated protein kinase kinase 1 CHEMBL3587	Ki	7.3	7.3	50.1	1
Mitogen-activated protein kinase kinase kinase kinase 4 CHEMBL6166	Ki	7.3	7.3	50.1	1
Receptor-type tyrosine-protein kinase FLT3 CHEMBL1974	Ki	7.2	7.2	63.1	1

Activity Data Samples

Top measurements by pChEMBL value

Target	Type	Rel.	Value	Units	pChEMBL	Assay	PubMed
Leucine-rich repeat serine/threonine-protein kinase 2	Ki	=	0.631	nM	9.2	PUBCHEM_BIOASSAY: Navigating the Kinome. (Class of assay: other) Panel member na...	-
5'-AMP-activated protein kinase catalytic subunit alpha-1	Ki	=	1.0	nM	9.0	PUBCHEM_BIOASSAY: Navigating the Kinome. (Class of assay: other) Panel member na...	-
Proto-oncogene tyrosine-protein kinase receptor Ret	Ki	=	1.259	nM	8.9	PUBCHEM_BIOASSAY: Navigating the Kinome. (Class of assay: other) Panel member na...	-
Proto-oncogene tyrosine-protein kinase ROS	Ki	=	2.512	nM	8.6	PUBCHEM_BIOASSAY: Navigating the Kinome. (Class of assay: other) Panel member na...	-
Serine/threonine-protein kinase Chk2	Ki	=	2.512	nM	8.6	PUBCHEM_BIOASSAY: Navigating the Kinome. (Class of assay: other) Panel member na...	-
Macrophage-stimulating protein receptor	Ki	=	3.981	nM	8.4	PUBCHEM_BIOASSAY: Navigating the Kinome. (Class of assay: other) Panel member na...	-
Aurora kinase A	Ki	=	3.981	nM	8.4	PUBCHEM_BIOASSAY: Navigating the Kinome. (Class of assay: other) Panel member na...	-
Platelet-derived growth factor receptor beta	Ki	=	3.981	nM	8.4	PUBCHEM_BIOASSAY: Navigating the Kinome. (Class of assay: other) Panel member na...	-
Mitogen-activated protein kinase kinase kinase kinase 2	Ki	=	5.012	nM	8.3	PUBCHEM_BIOASSAY: Navigating the Kinome. (Class of assay: other) Panel member na...	-
Vascular endothelial growth factor receptor 3	Ki	=	5.012	nM	8.3	PUBCHEM_BIOASSAY: Navigating the Kinome. (Class of assay: other) Panel member na...	-
Serine/threonine-protein kinase PLK4	Ki	=	6.31	nM	8.2	PUBCHEM_BIOASSAY: Navigating the Kinome. (Class of assay: other) Panel member na...	-
Tyrosine-protein kinase Lck	Ki	=	6.31	nM	8.2	PUBCHEM_BIOASSAY: Navigating the Kinome. (Class of assay: other) Panel member na...	-
Non-receptor tyrosine-protein kinase TYK2	Ki	=	6.31	nM	8.2	PUBCHEM_BIOASSAY: Navigating the Kinome. (Class of assay: other) Panel member na...	-
Tyrosine-protein kinase Blk	Ki	=	7.943	nM	8.1	PUBCHEM_BIOASSAY: Navigating the Kinome. (Class of assay: other) Panel member na...	-
Tyrosine-protein kinase Fyn	Ki	=	7.943	nM	8.1	PUBCHEM_BIOASSAY: Navigating the Kinome. (Class of assay: other) Panel member na...	-
Receptor tyrosine-protein kinase erbB-4	Ki	=	7.943	nM	8.1	PUBCHEM_BIOASSAY: Navigating the Kinome. (Class of assay: other) Panel member na...	-
Vascular endothelial growth factor receptor 1	Ki	=	7.943	nM	8.1	PUBCHEM_BIOASSAY: Navigating the Kinome. (Class of assay: other) Panel member na...	-
Fibroblast growth factor receptor 1	Ki	=	7.943	nM	8.1	PUBCHEM_BIOASSAY: Navigating the Kinome. (Class of assay: other) Panel member na...	-
Vascular endothelial growth factor receptor 2	Ki	=	7.943	nM	8.1	PUBCHEM_BIOASSAY: Navigating the Kinome. (Class of assay: other) Panel member na...	-
Serine/threonine-protein kinase 17A	Ki	=	7.943	nM	8.1	PUBCHEM_BIOASSAY: Navigating the Kinome. (Class of assay: other) Panel member na...	-

Data from ChEMBL 36 via Core Engine