BDBM50531713 CHEMBL4445864

SMILES CCCCCCCCCCc1ccc(NC(=O)C(=O)N2C[C@H](Oc3ccc(CCS(=O)(=O)OCC)cc3)[C@@H](C2)Oc2ccc(\C=C\S(=O)(=O)OCC)cc2)cc1

InChI Key InChIKey=CRUPUHJUVOOKRI-UHFFFAOYSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50531713   

TargetTyrosine-protein phosphatase non-receptor type 1(Human)
Shanghai Jiao Tong University (Sjtu)

Curated by ChEMBL
LigandPNGBDBM50531713(CHEMBL4445864)
Affinity DataIC50: 1.08E+3nMAssay Description:Inhibition of PTP1B (unknown origin) using pNPP as substrate after 30 minsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/26/2021
Entry Details Article
PubMed
TargetTyrosine-protein phosphatase non-receptor type 2(Human)
Shanghai Jiao Tong University (Sjtu)

Curated by ChEMBL
LigandPNGBDBM50531713(CHEMBL4445864)
Affinity DataIC50: 3.44E+3nMAssay Description:Inhibition of TCPTP (unknown origin) using pNPP as substrate after 30 minsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/26/2021
Entry Details Article
PubMed
TargetTyrosine-protein phosphatase non-receptor type 11(Human)
Shanghai Jiao Tong University (Sjtu)

Curated by ChEMBL
LigandPNGBDBM50531713(CHEMBL4445864)
Affinity DataIC50: 3.29E+3nMAssay Description:Inhibition of SHP2 (unknown origin) using pNPP as substrate after 30 minsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/26/2021
Entry Details Article
PubMed