BDBM50666959 CHEMBL6168173

SMILES c1ccc(cc1)/C=C/C(=O)N2CCC3(CCCC(=O)N3c4ccc(c(c4)F)Cl)CC2

InChI Key InChIKey=QOKKDKNMZGDVHI-UHFFFAOYSA-N

Data  3 IC50

PDB links: 1 PDB ID matches this monomer.

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50666959   

TargetLeukotriene C4 synthase(Human)
Novartis Pharma AG

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50666959BDBM50666959(CHEMBL6168173)
Affinity DataIC50: 17nMAssay Description:Inhibition of LTC4S in human PBMC cells assessed as inhibition of calcium ionophore A23187 stimulated LTC4 release preincubated for 15 mins followed ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In Depth
Date in BDB:
6/6/2026
Entry Details
PubMedPDB3D3D Structure (crystal)
TargetLeukotriene C4 synthase(Human)
Novartis Pharma AG

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50666959BDBM50666959(CHEMBL6168173)
Affinity DataIC50: 27nMAssay Description:Inhibition of human LTC4S assessed as conversion of LTA4-Me to LTC4-Me using GSH as substrate preincubated for 15 mins followed by substrate addition...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In Depth
Date in BDB:
6/6/2026
Entry Details
PubMedPDB3D3D Structure (crystal)
TargetLeukotriene C4 synthase(Human)
Novartis Pharma AG

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50666959BDBM50666959(CHEMBL6168173)
Affinity DataIC50: 43nMAssay Description:Inhibition of LTC4S in human whole blood assessed as inhibition of calcium ionophore A23187 stimulated LTC4 release preincubated with compound for 4 ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In Depth
Date in BDB:
6/6/2026
Entry Details
PubMedPDB3D3D Structure (crystal)