BDBM50587595 CHEMBL5083169::US11661419, Example 23::US20230280220, Example 23

SMILES [H][C@@]12C[C@]1(C)Cc1[nH]nc(c1C2)-c1nc2cc(cc(F)c2[nH]1)N(C)C(=O)[C@@H](C)N1CCOCC1=O

InChI Key InChIKey=MWXHTQHHPZLBPI-UHFFFAOYSA-N

Data  4 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50587595   

TargetTyrosine-protein kinase ITK/TSK(Human)
Therachem Research Medilab

Curated by ChEMBL
LigandPNGBDBM50587595(CHEMBL5083169 | US11661419, Example 23 | US2023028...)
Affinity DataIC50: 124nMAssay Description:Inhibition of ITK (unknown origin) using BTK peptide as substrate preincubated for 30 mins followed by addition of substrate and measured after 60 mi...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/7/2023
Entry Details Article
PubMed
TargetInterleukin-2(Human)
Therachem Research Medilab

Curated by ChEMBL
LigandPNGBDBM50587595(CHEMBL5083169 | US11661419, Example 23 | US2023028...)
Affinity DataIC50: 304nMAssay Description:Inhibition of IL-2 in CD3/CD28 activated human CD4+ve Th cells preincubated for 15 mins followed by addition of immuno-cult and measured after 24 hrs...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/7/2023
Entry Details Article
PubMed
TargetTyrosine-protein kinase ITK/TSK(Human)
Therachem Research Medilab

Curated by ChEMBL
LigandPNGBDBM50587595(CHEMBL5083169 | US11661419, Example 23 | US2023028...)
Affinity DataIC50: 124nMAssay Description:ITK activity was determined by measuring the effect of a test compound in an ITK enzyme assay. 1.0 M HEPES Buffer pH 7.5 solution was prepared as fol...More data for this Ligand-Target Pair
In Depth
Date in BDB:
10/17/2023
Entry Details
Go to US Patent

TargetTyrosine-protein kinase ITK/TSK(Human)
Therachem Research Medilab

Curated by ChEMBL
LigandPNGBDBM50587595(CHEMBL5083169 | US11661419, Example 23 | US2023028...)
Affinity DataIC50: 124nMAssay Description:1.0M HEPES Buffer pH 7.5 solution was prepared as follows: 238.3 g HEPES free acid (Sigma) and 800 mL of water were combined, and the mixture was sti...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/2/2023
Entry Details
Go to US Patent