Compound Detail

CHEMBL3616718

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CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H](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(=O)O)NC(=O)C(C)(C)NC(=O)[C@@H](N)Cc1c[nH]cn1)[C@@H](C)O)[C@@H](C)O)C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)O)C(C)C

ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID	CHEMBL3616718
Phase	Preclinical
Structure Type	BOTH
InChI Key	LQBSSRMCYDZQLJ-WDOXRSBNSA-N

Targets

Activities

Assay Types

PK Parameters

Publications

Known Names

Molecular Properties

3397.8

MW (Da)

Drug Information

Molecule Type	Protein
Availability	Unknown
Chirality	Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula	C152H230N42O47
MW	3397.76

Activity Summary

IC50 2 meas. best 10.1

EC50 1 meas.

Target Activity Profile

Target	Type	Best pChEMBL	Mean pChEMBL	Best (nM)	# Data
Glucagon-like peptide 1 receptor CHEMBL1784	IC50	10.1	9.935	0.1	2

Activity Data Samples

Top measurements by pChEMBL value

Target	Type	Rel.	Value	Units	pChEMBL	Assay	PubMed
Glucagon-like peptide 1 receptor	IC50	=	0.08	nM	10.1	Displacement of [125I]-GLP1 from human GLP1 receptor expressed in BHK cells afte...	26308095
Glucagon-like peptide 1 receptor	IC50	=	0.17	nM	9.77	Displacement of [125I]-GLP1 from human GLP1 receptor expressed in BHK cells afte...	26308095

Literature References

PubMed	DOI	Target Context	# Activities
26308095	10.1021/acs.jmedchem.5b00726	Glucagon-like peptide 1 receptor	4

Data from ChEMBL 36 via Core Engine