BDBM248061 SMY-471

SMILES CCCCCCCCCCCCC\C=C\[C@@H](O)[C@@H](N)COCc1cccc(n1)-c1ccccn1

InChI Key InChIKey=YAHKEYSOXIOPGY-QOFCPZNDSA-N

Data  1 KI  1 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 3 hits for monomerid = 248061   

TargetSphingomyelinase C(Bacillus cereus)
Tokushima Bunri University

LigandPNGBDBM248061(SMY-471)
Affinity DataKi:  2.80E+3nM ΔG°:  -7.87kcal/mole IC50:  900nMpH: 7.5 T: 2°CAssay Description:Briefly, Bc-SMase (50 ng/ml) was treated at 37 °C for 60 min with various compounds that were solubilized in dimethylacetoamide. The reaction mix...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetSphingomyelinase C(Bacillus cereus)
Tokushima Bunri University

LigandPNGBDBM248061(SMY-471)
Affinity DataKi:  2.80E+3nMAssay Description:Functional potency against Tachykinin receptor 2 (NK2) in rabbit pulmonary artery assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails
TargetSphingomyelinase C(Bacillus cereus)
Tokushima Bunri University

LigandPNGBDBM248061(SMY-471)
Affinity DataIC50:  900nMAssay Description:Functional potency against Tachykinin receptor 2 (NK2) in rabbit pulmonary artery assayMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails