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Compile Data Set for Download or QSAR
Found
1
Enz. Inhib. hit(s) with Target = 'P2Y purinoceptor 12' and Ligand = 'BDBM50336787'
Target
P2Y purinoceptor 12
(Homo sapiens (Human))
University of Bonn
Curated by
ChEMBL
Ligand
BDBM50336787
(CHEMBL445413 | sodium 1-amino-9,10-dioxo-4-(m-toly...)
Show SMILES
Cc1cccc(Nc2cc(c(N)c3C(=O)c4ccccc4C(=O)c23)S([O-])(=O)=O)c1
Show InChI
InChI=1S/C21H16N2O5S/c1-11-5-4-6-12(9-11)23-15-10-16(29(26,27)28)19(22)18-17(15)20(24)13-7-2-3-8-14(13)21(18)25/h2-10,23H,22H2,1H3,(H,26,27,28)/p-1
Affinity Data
Ki: 1.00E+4nM
Assay Description:
Displacement of [3H]PSB0413 from human platelet P2Y12 receptor
More data for this Ligand-Target Pair
Target Info
PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
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Ligand Info
CHEMBL
PC cid
PC sid
Similars
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Details
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PubMed