BDBM642627 US20230416245, Compound 65

SMILES CNC(=O)[C@]12C[C@@H]1[C@H]([C@H](O)[C@@H]2O)n1cnc2c(NCC3CCC3)cc(Cl)nc12

InChI Key InChIKey=QPZAKQBRIFEDQQ-HGQNHWLISA-N

Data  1 KI

  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 1 hit for monomerid = 642627   

TargetAdenosine receptor A3(Homo sapiens (Human))
Biointervene

US Patent
LigandPNGBDBM642627(US20230416245, Compound 65)
Affinity DataKi:  3.49nMAssay Description:Radioligand-binding assays were performed using the adenosine A3 receptor agonist [125I]-AB-MECA and the A1 receptor agonist [3H]CCPA. Binding assays...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent