BDBM558697 O1-methyl O4-[1-[4- [methyl(tetrahydro- pyran-4-yl)amino]-5- oxido-6,7-dihydro- thieno[3,2-d]pyrimidin- 5-ium-2-yl]azetidin-3-yl] piperidine-1,4- dicarboxylate::US11365204, Example 52

SMILES COC(=O)N1CCC(CC1)C(=O)OC1CN(C1)c1nc2CC[S+]([O-])c2c(n1)N(C)C1CCOCC1

InChI Key InChIKey=KIMCACLVRMCURC-UHFFFAOYSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 558697   

TargetcAMP-specific 3',5'-cyclic phosphodiesterase 4D(Human)
Union Therapeutics

US Patent
LigandPNGBDBM558697(US11365204, Example 52 | O1-methyl O4-[1-[4- [meth...)
Affinity DataIC50: 100nMAssay Description:The human PDE4D catalytic domain (UniProt no. Q08499 [S380-L740]) was incubated with a mixture of non-labelled cAMP (cyclic adenosine monophosphate) ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/25/2022
Entry Details
US Patent

TargetTumor necrosis factor(Human)
Union Therapeutics

US Patent
LigandPNGBDBM558697(US11365204, Example 52 | O1-methyl O4-[1-[4- [meth...)
Affinity DataIC50: 100nMAssay Description:Human peripheral blood mononuclear cells (PBMC) were isolated from fresh buffy coats by density centrifugation using lymphoprep tubes (Medinor). Froz...More data for this Ligand-Target Pair
In Depth
Date in BDB:
9/25/2022
Entry Details
US Patent