Compound Detail

CHEMBL4642849

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ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID	CHEMBL4642849
Phase	Preclinical
Structure Type	MOL
InChI Key	NPVQLUONYRGXER-VQQBFFDLSA-N

Targets

Activities

Assay Types

PK Parameters

Publications

Known Names

Molecular Properties

3146.7

MW (Da)

Drug Information

Molecule Type	Unknown
Availability	Unknown
Chirality	Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula	C147H205N37O35S3
MW	3146.68

Activity Summary

Ki 1 meas. best 8.55

Target Activity Profile

Target	Type	Best pChEMBL	Mean pChEMBL	Best (nM)	# Data
Ephrin type-A receptor 2 CHEMBL2068	Ki	8.55	8.55	2.8	1

Pharmacokinetic Data

Parameter	Value	Units	Species
Fu	-	-	Homo sapiens

Activity Data Samples

Top measurements by pChEMBL value

Target	Type	Rel.	Value	Units	pChEMBL	Assay	PubMed
Ephrin type-A receptor 2	Ki	=	2.83	nM	8.55	Binding affinity to 6x-His-tagged human EphA2 ecto-domain residues (Lys27 to Asn...	32202781

Literature References

PubMed	DOI	Target Context	# Activities
32202781	10.1021/acs.jmedchem.9b02129	ADMET	2
32202781	10.1021/acs.jmedchem.9b02129	Ephrin type-A receptor 2	1

Data from ChEMBL 36 via Core Engine