Compound Detail

CHEMBL7463

GF-109203

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CN(C)CCCn1cc(C2=C(c3c[nH]c4ccccc34)C(=O)NC2=O)c2ccccc21

ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID	CHEMBL7463
Name	GF-109203
Phase	Preclinical
Structure Type	MOL
InChI Key	QMGUOJYZJKLOLH-UHFFFAOYSA-N

Targets

Activities

Assay Types

PK Parameters

Publications

Known Names

Molecular Properties

412.5

MW (Da)

3.64

ALogP

HBA

HBD

70.1

PSA (Å²)

0.48

QED

Ro5 Violations

Rot. Bonds

Drug Information

Molecule Type	Small molecule
Availability	Unknown
Chirality	Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula	C25H24N4O2
MW	412.49
Aromatic Rings	4
Heavy Atoms	31
NP-Likeness	-0.59

Activity Summary

IC50 52 meas. best 9.88

Ki 2 meas. best 7.85

Kd 1 meas. best 8.0

Target Activity Profile

Target	Type	Best pChEMBL	Mean pChEMBL	Best (nM)	# Data
Serine/threonine-protein kinase LMTK3 CHEMBL4523432	IC50	9.88	9.88	0.1	1
Protein kinase C beta type CHEMBL3045	IC50	8.8	8.1233	1.6	3
Protein kinase C alpha type CHEMBL299	IC50	8.64	8.32	2.3	2
cAMP-dependent protein kinase catalytic subunit alpha CHEMBL4101	IC50	8.3	8.3	5.0	1
Protein kinase C epsilon type CHEMBL3582	IC50	8.22	8.1067	6.0	3
Protein kinase C theta type CHEMBL3920	IC50	8.17	8.17	6.7	1
Protein kinase C delta type CHEMBL2996	IC50	8.06	7.78	8.7	2
Unchecked CHEMBL612545	IC50	8.0	6.507	10.0	10
Protein kinase C eta type CHEMBL3616	IC50	8.0	8.0	10.0	1
Serine/threonine-protein kinase pim-1 CHEMBL2147	Kd	8.0	8.0	10.0	1
Unchecked CHEMBL612545	Ki	7.85	7.075	14.0	2
Protein kinase C alpha type CHEMBL2213	IC50	7.7	7.7	20.0	1
Serine/threonine-protein kinase pim-1 CHEMBL2147	IC50	7.57	7.57	27.0	2
Protein kinase C gamma type CHEMBL2938	IC50	7.52	7.52	30.0	1
Glycogen synthase kinase-3 beta CHEMBL262	IC50	6.72	6.72	190.0	2
Protein kinase C (PKC) CHEMBL2093867	IC50	6.72	6.4533	190.0	3
Glycogen synthase kinase-3 beta CHEMBL3669	IC50	6.44	6.44	360.0	1
Ribosomal protein S6 kinase alpha-1 CHEMBL2553	IC50	6.21	6.21	610.0	1
Platelet CHEMBL4296519	IC50	6.12	6.09	760.0	2
Cyclin-dependent kinase 4/cyclin D1 CHEMBL1907601	IC50	6.0	6.0	990.0	1
Voltage-gated inwardly rectifying potassium channel KCNH2 CHEMBL240	IC50	6.0	6.0	1000.0	1
Lethal factor CHEMBL4372	IC50	5.82	5.82	1500.0	1
cAMP-dependent protein kinase (PKA) CHEMBL2094138	IC50	5.7	5.7	2000.0	1
Cyclin-dependent kinase 1/cyclin B CHEMBL2094127	IC50	5.64	5.18	2300.0	2
Protein kinase C iota type CHEMBL2598	IC50	5.46	5.46	3463.0	1
Protein kinase C zeta type CHEMBL3438	IC50	5.24	5.24	5800.0	1
NAD-dependent protein deacetylase sirtuin-2 CHEMBL4462	IC50	5.14	5.07	7300.0	3
Cyclin-dependent kinase 2/cyclin E CHEMBL2094126	IC50	4.99	4.99	10180.0	1
NAD-dependent protein deacetylase sirtuin-1 CHEMBL4506	IC50	4.64	4.64	23000.0	1
Protein kinase Pfmrk CHEMBL4090	IC50	4.62	4.62	24000.0	1

Activity Data Samples

Top measurements by pChEMBL value

Target	Type	Rel.	Value	Units	pChEMBL	Assay	PubMed
Serine/threonine-protein kinase LMTK3	IC50	=	0.1318	nM	9.88	Inhibition of N-terminal GST tag LMTK3 kinase domain (133 to 415 amino acids) (u...	-
Protein kinase C beta type	IC50	=	1.6	nM	8.8	Inhibition of PKCbeta1 by SPA	19827831
Protein kinase C alpha type	IC50	=	2.3	nM	8.64	Inhibition of PKCalpha by SPA	19827831
cAMP-dependent protein kinase catalytic subunit alpha	IC50	=	5.0	nM	8.3	Inhibition of human PKAC-alpha	36055000
Protein kinase C epsilon type	IC50	=	6.0	nM	8.22	Inhibition of human PKCepsilon	17875639
Protein kinase C epsilon type	IC50	=	6.6	nM	8.18	Inhibition of PKCepsilon by SPA	19827831
Protein kinase C theta type	IC50	=	6.7	nM	8.17	Inhibition of PKCtheta by SPA	19827831
Protein kinase C delta type	IC50	=	8.7	nM	8.06	Inhibition of PKCdelta by SPA	19827831
Protein kinase C eta type	IC50	=	10.0	nM	8.0	Inhibition of PKCeta by SPA	19827831
Unchecked	IC50	=	10.0	nM	8.0	Inhibition of bovine brain protein kinase C using lysine-rich histone type 3-s a...	30026041
Protein kinase C alpha type	IC50	=	10.0	nM	8.0	Inhibition of Protein kinase C alpha	-
Serine/threonine-protein kinase pim-1	Kd	=	10.0	nM	8.0	Binding affinity to non phosphorylated PIM1	16302800
Unchecked	IC50	=	10.0	nM	8.0	Inhibition of bovine brain PKC in presence of [p32-gamma]-ATP measured after 10 ...	1874734
Protein kinase C epsilon type	IC50	=	12.0	nM	7.92	Inhibition of human PKCepsilon type M486A mutant	17875639
Unchecked	Ki	=	14.0	nM	7.85	Displacement of [3H]PDBu from PKC in bovine brain assessed as inhibition constan...	1874734
Protein kinase C beta type	IC50	=	16.0	nM	7.8	Inhibition of human PKCbeta2 expressed in baculovirus infected Sf9 insect cells ...	1874734
Protein kinase C beta type	IC50	=	17.0	nM	7.77	Inhibition of human PKCbeta1 expressed in baculovirus infected Sf9 insect cells ...	1874734
Unchecked	IC50	=	20.0	nM	7.7	Inhibition of bovine PKCgamma expressed in baculovirus infected Sf9 insect cells...	1874734
Protein kinase C alpha type	IC50	=	20.0	nM	7.7	Inhibition of bovine PKCalpha expressed in baculovirus infected Sf9 insect cells...	1874734
Serine/threonine-protein kinase pim-1	IC50	=	27.0	nM	7.57	Inhibition of human recombinant Pim1 by ATP depletion assay	19072652

Literature References

PubMed	DOI	Target Context	# Activities
-	10.6019/CHEMBL5724801	U2OS	320
-	10.6019/CHEMBL5724801	Fibroblast	320
-	10.6019/CHEMBL5724801	HEK-293T	320
8904648	10.1111/j.1476-5381.1996.tb15733.x	Unchecked	21
1874734	10.1016/s0021-9258(18)98476-0	Unchecked	14
-	10.6019/CHEMBL4689842	HEK-293T	10
19540764	10.1016/j.bmc.2009.05.054	Protective antigen	10
-	10.6019/CHEMBL5724696	U2OS	8
-	10.6019/CHEMBL4689842	U2OS	7
-	10.6019/CHEMBL4689842	Fibroblast	7
1874734	10.1016/s0021-9258(18)98476-0	NIH3T3	6
-	10.6019/CHEMBL5303304	HEK-293T	5
16302800	10.1021/jm0504858	Serine/threonine-protein kinase pim-1	5
19053831	10.1021/jm800758s	Streptomyces lividans	5
-	10.6019/CHEMBL5303304	U2OS	5
1874734	10.1016/s0021-9258(18)98476-0	Protein kinase C (PKC)	5
10998351	10.1042/0264-6021:3510095	Unchecked	5
-	10.6019/CHEMBL5303304	Fibroblast	5
23398362	10.1042/bj20121418	Serine/threonine-protein kinase mTOR	4
23398362	10.1042/bj20121418	cGMP-dependent protein kinase 1	4

Data from ChEMBL 36 via Core Engine