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null
SMILES
COc1ccc2c(OCc3cccc(c3)S(C)(=N)=O)ccnc2c1
InChI Key
Tab Delimited (
TSV
)
2D SDfile
Computed 3D by
Vconf
-m prep SDfile
Find this compound or compounds like it in BindingDB:
GO
Substructure
Similarity at least:
must be >=0.5
Exact match
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found
4
hits for monomerid = 624556
Target
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1
(Homo sapiens (Human))
TBA
Ligand
BDBM624556
(US11780849, Compound 133 | imino(3-{[(7-methoxyqui...)
copy SMILES
Affinity Data
Ki: <3nM
More data for this Ligand-Target Pair
Target Info
PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
Ligand Info
PC cid
PC sid
In Depth
Details
Target
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1
(Homo sapiens (Human))
TBA
Ligand
BDBM624556
(US11780849, Compound 133 | imino(3-{[(7-methoxyqui...)
copy SMILES
Affinity Data
Ki: 120nM
More data for this Ligand-Target Pair
Target Info
PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
Ligand Info
PC cid
PC sid
In Depth
Details
Target
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1
(Homo sapiens (Human))
TBA
Ligand
BDBM624556
(US11780849, Compound 133 | imino(3-{[(7-methoxyqui...)
copy SMILES
Affinity Data
IC50: 1.40E+3nM
More data for this Ligand-Target Pair
Target Info
PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
Ligand Info
PC cid
PC sid
In Depth
Details
Target
Ectonucleotide pyrophosphatase/phosphodiesterase family member 1
(Homo sapiens (Human))
TBA
Ligand
BDBM624556
(US11780849, Compound 133 | imino(3-{[(7-methoxyqui...)
copy SMILES
Affinity Data
IC50: 10nM
More data for this Ligand-Target Pair
Target Info
PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
Ligand Info
PC cid
PC sid
In Depth
Details