Compound Detail

CHEMBL426697

YSTCYFIM

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CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)C(=O)N[C@@H](CCSC)C(=O)O

ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID	CHEMBL426697
Name	YSTCYFIM
Phase	Preclinical
Structure Type	BOTH
InChI Key	GPHZOMOHUGDLPM-XAQATAOCSA-N

Targets

Activities

Assay Types

PK Parameters

Publications

Known Names

Molecular Properties

1027.2

MW (Da)

Drug Information

Molecule Type	Protein
Availability	Unknown
Chirality	Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula	C48H66N8O13S2
MW	1027.23

Activity Summary

IC50 3 meas. best 9.0

EC50 1 meas. best 7.89

Target Activity Profile

Target	Type	Best pChEMBL	Mean pChEMBL	Best (nM)	# Data
Receptor-histidine kinase AgrC CHEMBL4726	IC50	9.0	7.52	1.0	3
Receptor-histidine kinase AgrC CHEMBL4726	EC50	7.89	7.89	13.0	1

Activity Data Samples

Top measurements by pChEMBL value

Target	Type	Rel.	Value	Units	pChEMBL	Assay	PubMed
Receptor-histidine kinase AgrC	IC50	=	1.0	nM	9.0	Concentration required to antagonise accessory gene regulator C3 of Staphylococc...	15341477
Receptor-histidine kinase AgrC	IC50	=	4.0	nM	8.4	Concentration required to antagonise accessory gene regulator C2 of Staphylococc...	15341477
Receptor-histidine kinase AgrC	EC50	=	13.0	nM	7.89	Effective concentration to antagonise accessory gene regulator C4 of Staphylococ...	15341477
Receptor-histidine kinase AgrC	IC50	=	7000.0	nM	5.16	Antagonistic concentration for accessory gene regulator C1 of Staphylococcus aur...	15341477

Literature References

PubMed	DOI	Target Context	# Activities
15341477	10.1021/jm0400754	Receptor-histidine kinase AgrC	4

Data from ChEMBL 36 via Core Engine