Assay Detail

CHEMBL4236913

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Binding

Binding affinity to human integrin alphaVbeta6 after 24 hrs by liquid scintillation counting

ChEMBL ↗

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Target

Integrin alpha-V/beta-6 (CHEMBL2111416) ↗

Open DB target context

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Integrin alpha-V/beta-6 (CHEMBL2111416) is the working anchor for this assay review. Loading the live Open DB target snapshot…

Primary target Integrin alpha-V/beta-6

CHEMBL2111416

Anchored from Assay target.

Protein identity Integrin alpha-V/beta-6

Disease frame Disease evidence pending

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Review focus Open DB context pending

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Total Activities

Compounds Tested

Activity Types

Assay Parameters

Assay Information

Assay Type	Binding
Organism	Homo sapiens
Confidence	7 — Homologous single protein target
Curated By	Intermediate

Target

Integrin alpha-V/beta-6 (CHEMBL2111416) ↗

Type	PROTEIN COMPLEX
Organism	Homo sapiens

Publication

Discovery of ( S)-3-(3-(3,5-Dimethyl-1 H-pyrazol-1-yl)phenyl)-4-(( R)-3-(2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethyl)pyrrolidin-1-yl)butanoic Acid, a Nonpeptidic αvβ6 Integrin Inhibitor for the Inhaled Treatment of Idiopathic Pulmonary Fibrosis.

Procopiou PA, Anderson NA, Barrett J, Barrett TN, Crawford MHJ, Fallon BJ, Hancock AP, Le J, Lemma S, Marshall RP, Morrell J, Pritchard JM, Rowedder JE, Saklatvala P, Slack RJ, Sollis SL, Suckling CJ, Thorp LR, Vitulli G, Macdonald SJF.
J Med Chem (2018) 61 : 8417 -8443
PubMed 30215258 · DOI

Activity Statistics

Type	Count	Avg pChEMBL	Best pChEMBL
Kd	2	10.75	10.80

Compounds Tested

Compound	Name	Phase	Activities	Best pChEMBL
CHEMBL4241824	GSK-3008348 FREE BASE	1.0	2	10.80

Activity Data

Compound	Name	Type	Rel.	Value	Units	pChEMBL
CHEMBL4241824	GSK-3008348 FREE BASE	Kd	=	0.01585	nM	10.80
CHEMBL4241824	GSK-3008348 FREE BASE	Kd	=	0.02	nM	10.70