BDBM200565 BDBM200572::US9227973, 9 isomer A::US9227973, 9 isomer B::US9227973, 9 isomer C

SMILES O=C(NC1COC(Cc2cccnc12)c1ccccc1)c1cnc2C[C@]3(Cc2c1)C(=O)Nc1ncccc31

InChI Key InChIKey=PXWVLIBCTSQGLE-UHFFFAOYSA-N

Data  4 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 200565   

TargetCalcitonin gene-related peptide type 1 receptor(Human)
Merck Sharp & Dohme

US Patent
LigandPNGBDBM200565(US9227973, 9 isomer C | US9227973, 9 isomer B | BD...)
Affinity DataIC50: 1.90E+3nMT: 2°CAssay Description:RECOMBINANT RECEPTOR FUNCTIONAL ASSAY (Assay C): Cells were resuspended in DMEM/F12 (Hyclone) supplemented with 1 g/L BSA and 300 uM isobutyl-methylx...More data for this Ligand-Target Pair
In DepthDetails
US Patent

TargetCalcitonin gene-related peptide type 1 receptor(Human)
Merck Sharp & Dohme

US Patent
LigandPNGBDBM200565(US9227973, 9 isomer C | US9227973, 9 isomer B | BD...)
Affinity DataIC50: 1.10E+3nMT: 2°CAssay Description:RECOMBINANT RECEPTOR FUNCTIONAL ASSAY (Assay C): Cells were resuspended in DMEM/F12 (Hyclone) supplemented with 1 g/L BSA and 300 uM isobutyl-methylx...More data for this Ligand-Target Pair
In DepthDetails
US Patent

TargetCalcitonin gene-related peptide type 1 receptor(Human)
Merck Sharp & Dohme

US Patent
LigandPNGBDBM200565(US9227973, 9 isomer C | US9227973, 9 isomer B | BD...)
Affinity DataIC50: 1.10E+3nMT: 2°CAssay Description:RECOMBINANT RECEPTOR FUNCTIONAL ASSAY (Assay C): Cells were resuspended in DMEM/F12 (Hyclone) supplemented with 1 g/L BSA and 300 uM isobutyl-methylx...More data for this Ligand-Target Pair
In DepthDetails
US Patent

TargetCalcitonin gene-related peptide type 1 receptor(Human)
Merck Sharp & Dohme

US Patent
LigandPNGBDBM200565(US9227973, 9 isomer C | US9227973, 9 isomer B | BD...)
Affinity DataIC50: 480nMT: 2°CAssay Description:RECOMBINANT RECEPTOR FUNCTIONAL ASSAY (Assay C): Cells were resuspended in DMEM/F12 (Hyclone) supplemented with 1 g/L BSA and 300 uM isobutyl-methylx...More data for this Ligand-Target Pair
In DepthDetails
US Patent