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Compile Data Set for Download or QSAR
maximum 50k data
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
(change energy unit to
kcal/mol
)
Found
3
hits in this display
Target
Integrin alpha-4/beta-1
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50144789
((S)-2-{[(S)-1-(3,5-Dichloro-benzenesulfonyl)-azeti...)
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Affinity Data
IC50: 0.740nM
Assay Description:
Inhibition of Mn2+ activated state of very late antigen 4 (VLA-4)
More data for this Ligand-Target Pair
Target Info
PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
antibodypedia
GoogleScholar
Ligand Info
CHEMBL
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Integrin alpha-4/beta-1
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50144789
((S)-2-{[(S)-1-(3,5-Dichloro-benzenesulfonyl)-azeti...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 3.60nM
Assay Description:
Inhibition of [Ca2+]/Mg2+ unactivated state of very late antigen 4 (VLA-4)
More data for this Ligand-Target Pair
Target Info
PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
antibodypedia
GoogleScholar
Ligand Info
CHEMBL
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Integrin alpha-4/beta-7
(Homo sapiens (Human))
Merck Research Laboratories
Curated by
ChEMBL
Ligand
BDBM50144789
((S)-2-{[(S)-1-(3,5-Dichloro-benzenesulfonyl)-azeti...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 179nM
Assay Description:
Inhibition of Mn2+ activated state of alpha4-beta7 integrin
More data for this Ligand-Target Pair
Target Info
PDB
Reactome pathway
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
Ligand Info
CHEMBL
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI