BDBM50557727 CHEMBL4749989

SMILES O=C(Nc1nc2ccncc2s1)C1CC1c1ccccc1

InChI Key InChIKey=BMDQQOPBFHMQDL-UHFFFAOYSA-N

Data  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 2 hits for monomerid = 50557727   

TargetRho-associated protein kinase 2(Human)
Alcon

US Patent
LigandPNGBDBM50557727(CHEMBL4749989 | US12459956, Compound 12)
Affinity DataIC50: 12nMAssay Description:The assay buffer used in this screen is 0.05 M acetate, pH 4.2, 10% DMSO final, 100 uM genapol (which is a nonionic detergent, below its Critical Mic...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/23/2026
Entry Details US Patent

TargetRho-associated protein kinase 2(Human)
Alcon

US Patent
LigandPNGBDBM50557727(CHEMBL4749989 | US12459956, Compound 12)
Affinity DataIC50: 12nMAssay Description:Inhibition of ROCK2 (unknown origin) using KRRRLSSLRA as substrate incubated for 75 mins in presence of ATP and DTT by Kinase-Glo luminescent assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/26/2022
Entry Details Article
PubMed