BDBM50547836 CHEMBL4763593

SMILES C[C@H]1CN([C@H](CO1)CCO)C(=O)c2cc3c(c(c2)OC)oc(n3)N[C@H](CF)c4cccc(c4)Cl

InChI Key InChIKey=PLMHHBJXBHCBMU-UHFFFAOYSA-N

Data  3 IC50

PDB links: 1 PDB ID matches this monomer.

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50547836   

TargetThyroid hormone receptor beta(Human)
Bayer

Curated by ChEMBL
LigandPNGBDBM50547836(CHEMBL4763593)
Affinity DataIC50: 0.700nMAssay Description:Inhibition of purified human plasma thrombin using Boc-Asp(OBzl)-Pro-Arg-AMC substrate incubated for 30 mins by fluorescence based assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/22/2022
Entry Details Article
PubMed
TargetProthrombin(Rat)
Bayer

Curated by ChEMBL
LigandPNGBDBM50547836(CHEMBL4763593)
Affinity DataIC50: 10nMAssay Description:Inhibition of thrombin in rat plasmaMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/22/2022
Entry Details Article
PubMedPDB3D3D Structure (crystal)
TargetThrombin(Rabbit)
Bayer

Curated by ChEMBL
LigandPNGBDBM50547836(CHEMBL4763593)
Affinity DataIC50: 20nMAssay Description:Inhibition of thrombin in rabbit plasmaMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/22/2022
Entry Details Article
PubMedPDB3D3D Structure (crystal)