BDBM274957 US9556190, Example 45

SMILES C[C@@H]1CC[C@H](CN1C(=O)c1ccccc1-n1ncnn1)N(C)c1nccc2c1C(=O)OC2(C)C

InChI Key InChIKey=ZGPBKGLLZIBGSJ-HZPDHXFCSA-N

Data  2 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 2 hits for monomerid = 274957   

TargetOrexin/Hypocretin receptor type 1(Homo sapiens (Human))
Merck Sharp & Dohme

US Patent
LigandPNGBDBM274957(US9556190, Example 45)
Affinity DataIC50:  9.33E+3nMAssay Description: In a typical experiment the OX1 and OX2 receptor antagonistic activity of the compounds of the present invention was determined in accordance with t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent
TargetOrexin receptor type 2(Homo sapiens (Human))
Merck Sharp & Dohme

US Patent
LigandPNGBDBM274957(US9556190, Example 45)
Affinity DataIC50:  127nMAssay Description: In a typical experiment the OX1 and OX2 receptor antagonistic activity of the compounds of the present invention was determined in accordance with t...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent