Compound Detail

CHEMBL1910324

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CC[C@@H](C)[C@@H](N)C(=O)N[C@H](CC(C)C)C(=O)NCC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N[C@H](CCCNC(N)=O)C(=O)N[C@H](CC(=O)O)C(=O)N[C@H](Cc1ccc(O)cc1)C(=O)N[C@H](CCCCN)C(=O)O

ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID	CHEMBL1910324
Phase	Preclinical
Structure Type	BOTH
InChI Key	IVQBXMPXSLAIFC-OSMHAOILSA-N

Targets

Activities

Assay Types

PK Parameters

Publications

Known Names

Molecular Properties

1002.1

MW (Da)

Drug Information

Molecule Type	Protein
Availability	Unknown
Chirality	Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula	C45H71N13O13
MW	1002.14

Activity Summary

IC50 3 meas. best 7.89

Target Activity Profile

Target	Type	Best pChEMBL	Mean pChEMBL	Best (nM)	# Data
Prostaglandin F2-alpha receptor CHEMBL1909491	IC50	7.89	7.89	13.0	1
Prostaglandin F2-alpha receptor CHEMBL4820	IC50	7.89	7.89	13.0	1
Prostaglandin F2-alpha receptor CHEMBL5000	IC50	7.89	7.89	13.0	1

Activity Data Samples

Top measurements by pChEMBL value

Target	Type	Rel.	Value	Units	pChEMBL	Assay	PubMed
Prostaglandin F2-alpha receptor	IC50	=	13.0	nM	7.89	Antagonist activity at FP receptor in mouse myometrial strip assessed as inhibit...	21774512
Prostaglandin F2-alpha receptor	IC50	=	13.0	nM	7.89	Antagonist activity at FP receptor in bovine myometrial strip assessed as inhibi...	21774512
Prostaglandin F2-alpha receptor	IC50	=	13.0	nM	7.89	Antagonist activity at FP receptor in sheep myometrial strip assessed as inhibit...	21774512

Literature References

PubMed	DOI	Target Context	# Activities
21774512	10.1021/jm200608k	Prostaglandin F2-alpha receptor	6
21774512	10.1021/jm200608k	Mus musculus	1

Data from ChEMBL 36 via Core Engine