Compound Detail

CHEMBL272342

EFIPLADIB

🧪 Phase II

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 II

O=C(O)c1ccc(CCCc2c(CCNS(=O)(=O)Cc3ccc(Cl)c(Cl)c3)n(C(c3ccccc3)c3ccccc3)c3ccc(Cl)cc23)cc1

ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID	CHEMBL272342
Name	EFIPLADIB
Phase	Phase II
Structure Type	MOL
InChI Key	HIZOPJQOPKRKFM-UHFFFAOYSA-N

Known Names

Efipladib PLA-902

Targets

Activities

Assay Types

PK Parameters

Publications

Known Names

Molecular Properties

746.2

MW (Da)

9.77

ALogP

HBA

HBD

88.4

PSA (Å²)

0.12

QED

Ro5 Violations

Rot. Bonds

Drug Information

Molecule Type	Small molecule
Chirality	Achiral

USAN Stem	ef-; -pladib
USAN Year	2004

Extended Properties

Molecular Formula	C40H35Cl3N2O4S
MW	746.16
Aromatic Rings	6
Heavy Atoms	50
NP-Likeness	-0.90

Activity Summary

IC50 12 meas. best 9.27

Target Activity Profile

Target	Type	Best pChEMBL	Mean pChEMBL	Best (nM)	# Data
Cytosolic phospholipase A2 CHEMBL3816	IC50	9.27	8.335	0.5	2
MC9 CHEMBL614867	IC50	7.7	7.15	20.0	3
Unchecked CHEMBL612545	IC50	7.4	7.34	40.0	4
Blood CHEMBL613615	IC50	7.16	7.16	70.0	2
Whole blood CHEMBL2367389	IC50	6.96	6.96	110.0	1

Pharmacokinetic Data

Parameter	Value	Units	Species
CL	5.0	mL.min-1.kg-1	Rattus norvegicus
CL	5.0	mL.min-1.kg-1	Rattus norvegicus
F	1.0	%	Rattus norvegicus
F	6.0	%	Rattus norvegicus
F	6.0	%	Rattus norvegicus

Activity Data Samples

Top measurements by pChEMBL value

Target	Type	Rel.	Value	Units	pChEMBL	Assay	PubMed
Cytosolic phospholipase A2	IC50	=	0.54	nM	9.27	Inhibition of cPLA2alpha isolated from human U937 cell cytoplasm assessed as sup...	25102418
MC9	IC50	=	20.0	nM	7.7	Inhibition of LTB4 production in mouse MC9 cells	18498150
MC9	IC50	=	20.0	nM	7.7	Inhibition of PGF2alpha production in mouse MC9 cells	18498150
Unchecked	IC50	=	40.0	nM	7.4	Inhibition of human cPLA2-alpha assessed as cleavage of 7-hydroxycoumarinyl-gamm...	17998165
Unchecked	IC50	=	40.0	nM	7.4	Inhibition of cytosolic phospholipase A2alpha by GLU micelle assay	18498150
Cytosolic phospholipase A2	IC50	=	40.0	nM	7.4	Inhibition of human cytosolic PLA2alpha by GLU micelle assay	19178292
Unchecked	IC50	=	40.0	nM	7.4	Inhibition of cytosolic phospholipase A2alpha by GLU micelle assay	19482480
Unchecked	IC50	=	70.0	nM	7.16	Inhibition of cPLA2-alpha in Sprague-Dawley rat whole blood assay in presence of...	17998165
Blood	IC50	=	70.0	nM	7.16	Inhibition of TXB2 production in Sprague-Dawley rat whole blood	18498150
Blood	IC50	=	70.0	nM	7.16	Inhibition of A23187-induced TBX2 release in Sprague-Dawley rat whole blood	19178292
Whole blood	IC50	=	110.0	nM	6.96	Inhibition of A23187-induced TXB2 generation in human whole blood by EIA	25102418
MC9	IC50	=	900.0	nM	6.05	Inhibition of PGF2apha production in arachidonic acid-stimulated mouse MC9 cells	18498150

Literature References

PubMed	DOI	Target Context	# Activities
18498150	10.1021/jm701467e	Rattus norvegicus	16
18498150	10.1021/jm701467e	Blood	6
18498150	10.1021/jm701467e	Unchecked	5
17998165	10.1016/j.bmc.2007.10.060	Rattus norvegicus	3
18498150	10.1021/jm701467e	Ovis aries	3
18498150	10.1021/jm701467e	Cytochrome c oxidase subunit 2	3
18498150	10.1021/jm701467e	MC9	3
18498150	10.1021/jm701467e	Mus musculus	2
19178292	10.1021/jm8009876	Rattus norvegicus	2
17998165	10.1016/j.bmc.2007.10.060	Unchecked	2
18498150	10.1021/jm701467e	Cytochrome c oxidase subunit 1	1
18498150	10.1021/jm701467e	Cytosolic phospholipase A2 gamma	1
19178292	10.1021/jm8009876	Cytosolic phospholipase A2	1
19178292	10.1021/jm8009876	Blood	1
18498150	10.1021/jm701467e	Cytosolic phospholipase A2 beta	1
19482480	10.1016/j.bmc.2009.05.027	Unchecked	1
25102418	10.1021/jm500494y	Cytosolic phospholipase A2	1
25102418	10.1021/jm500494y	No relevant target	1
25102418	10.1021/jm500494y	NON-PROTEIN TARGET	1
25102418	10.1021/jm500494y	Mus musculus	1

Data from ChEMBL 36 via Core Engine