Compound Detail

CHEMBL4162789

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CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CO)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CO)NC(=O)[C@@H](N)Cc1cnc[nH]1)[C@@H](C)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(N)=O)[C@@H](C)O

ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID	CHEMBL4162789
Phase	Preclinical
Structure Type	MOL
InChI Key	UZIAYWPWJZKZAV-YRNBOFOQSA-N

Targets

Activities

Assay Types

PK Parameters

Publications

Known Names

Molecular Properties

3437.8

MW (Da)

Drug Information

Molecule Type	Unknown
Availability	Unknown
Chirality	Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula	C147H222N44O48S2
MW	3437.79

Activity Summary

EC50 1 meas. best 6.91

Target Activity Profile

Target	Type	Best pChEMBL	Mean pChEMBL	Best (nM)	# Data
Glucagon receptor CHEMBL1985	EC50	6.91	6.91	122.6	1

Activity Data Samples

Top measurements by pChEMBL value

Target	Type	Rel.	Value	Units	pChEMBL	Assay	PubMed
Glucagon receptor	EC50	=	122.57	nM	6.91	Agonist activity at human GCGR expressed in HEK293 cells assessed as increase in...	28772236

Literature References

PubMed	DOI	Target Context	# Activities
28772236	10.1016/j.ejmech.2017.07.046	Mus musculus	2
28772236	10.1016/j.ejmech.2017.07.046	Unchecked	1
28772236	10.1016/j.ejmech.2017.07.046	Glucagon receptor	1
28772236	10.1016/j.ejmech.2017.07.046	Glucagon-like peptide 1 receptor	1

Data from ChEMBL 36 via Core Engine