BDBM50576168 CHEMBL4855155

SMILES [H][C@]12CC[C@@]3([H])[C@]4([H])[C@@H](O)C[C@]5([H])C[C@@H](CC[C@]5(C)[C@@]4([H])CC[C@]13C)n1cc(CO[C@@H]3CC[C@@]4(C)[C@@]([H])(C3)C[C@H](O)[C@@]3([H])[C@]5([H])CC[C@]([H])([C@H](C)CCC(=O)NC(CNC(=O)CC[C@H]2C)C(O)=O)[C@@]5(C)CC[C@]43[H])nn1

InChI Key InChIKey=QEABWTBVQWDRKN-DJWFLNQTSA-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 = 50576168   

TargetSodium/bile acid cotransporter(Homo sapiens (Human))
National Institute Of Biological Sciences

Curated by ChEMBL
LigandPNGBDBM50576168(CHEMBL4855155)
Affinity DataIC50:  109nMAssay Description:Inhibition of human NTCP-mediated [3H]-TCA uptake expressed in human HepG2 cells in presence of 20 % FBSMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetSodium/bile acid cotransporter(Homo sapiens (Human))
National Institute Of Biological Sciences

Curated by ChEMBL
LigandPNGBDBM50576168(CHEMBL4855155)
Affinity DataIC50:  18nMAssay Description:Inhibition of human NTCP-mediated [3H]-TCA uptake expressed in human HepG2 cells pretreated for 2 hrs followed by [3H]-TCA addition in absence of FBSMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetSodium/bile acid cotransporter(Homo sapiens (Human))
National Institute Of Biological Sciences

Curated by ChEMBL
LigandPNGBDBM50576168(CHEMBL4855155)
Affinity DataIC50:  167nMAssay Description:Inhibition of human NTCP-mediated [3H]-TCA uptake expressed in human HepG2 cells in presence of 50 % FBSMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed