BDBM50520501 CHEMBL4549217

SMILES CNC(=O)O[C@@H](CC(C)C)c1nc(cs1)[C@@H](O)[C@@H](C)\C=C\C=C(/C)[C@@H](OC)[C@@H](C)[C@H](O)\C=C\C(\C)=C/C(/C)=C\[C@H](C)[C@H](O)\C=C(/C)\C=C\CC(=O)OC

InChI Key InChIKey=CHCVPROLISNQDZ-UHFFFAOYSA-N

Data  1 KI  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 3 hits for monomerid = 50520501   

TargetAdenosine receptor A3(Human)
Universit£T Bonn

Curated by ChEMBL
LigandPNGBDBM50520501(CHEMBL4549217)
Affinity DataKi:  1.61E+3nMAssay Description:Displacement of [3H]PSB-11 from human A3 adenosine receptor expressed in CHO cell membranes incubated for 60 mins by liquid scintillation counting me...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/23/2021
Entry Details Article
PubMed
TargetNeutrophil elastase(Human)
Universit£T Bonn

Curated by ChEMBL
LigandPNGBDBM50520501(CHEMBL4549217)
Affinity DataIC50: 2.34E+3nMAssay Description:Inhibition of human leukocyte elastase assessed as reduction in pNA release using chromogenic MeO-Suc-Ala-Ala-Pro-Val-pNA substrate measured over 10 ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/23/2021
Entry Details Article
PubMed
TargetP2X purinoceptor 3(Human)
Universit£T Bonn

Curated by ChEMBL
LigandPNGBDBM50520501(CHEMBL4549217)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of human P2X3 assessed as reduction in agonist-induced intracellular Ca2+ concentration pre-incubated for 30 mins before agonist addition ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/23/2021
Entry Details Article
PubMed