BDBM77029 US10093697, 3.::US10487111, Example 3.::US9694018, 3

SMILES CCCCC1(CCCC)CN(c2ccccc2)c2cc(SC)c(OCC(=O)N[C@@H](C(=O)N[C@@H](CC)C(O)=O)c3ccccc3)cc2S(=O)(=O)N1

InChI Key InChIKey=PWMAUDHMHOFLLG-IPZQJPLYSA-N

Data  3 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 3 hits for monomerid = 77029   

TargetBile acid receptor(Human)
Albireo

US Patent
LigandPNGBDBM77029(US10093697, 3. | US10487111, Example 3. | US969401...)
Affinity DataIC50:  0.180nMAssay Description:ISBT Hu HEK Uptake SPA 13203 IBAT HUM Ileal Bile Acid Transporter Human HEK Glycocholic acid Uptake Radiometric¿SPA Inhibitor IC50 Mean IC50 (nM) was...More data for this Ligand-Target Pair
In DepthDetails US Patent


TargetIleal sodium/bile acid cotransporter(Human)
Albireo

US Patent
LigandPNGBDBM77029(US10093697, 3. | US10487111, Example 3. | US969401...)
Affinity DataIC50:  0.180nMAssay Description:ISBT Hu HEK Uptake SPA 13203 IBAT HUM Ileal Bile Acid Transporter Human HEK Glycocholic acid Uptake Radiometric—SPA Inhibitor IC50 Mean IC50 (nM) was...More data for this Ligand-Target Pair
In DepthDetails US Patent


TargetIleal sodium/bile acid cotransporter(Human)
Albireo

US Patent
LigandPNGBDBM77029(US10093697, 3. | US10487111, Example 3. | US969401...)
Affinity DataIC50:  0.180nMAssay Description:ISBT Hu HEK Uptake SPA 13203 IBAT HUM Ileal Bile Acid Transporter Human HEK Glycocholic acid Uptake Radiometric SPA Inhibitor IC50 Mean IC50 (nM) was...More data for this Ligand-Target Pair
In DepthDetails US Patent