BDBM50037785 2-(6-{[2-(4-aminophenyl)ethyl]amino}-9H-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol::2-{6-[2-(4-Amino-phenyl)-ethylamino]-purin-9-yl}-5-hydroxymethyl-tetrahydro-furan-3,4-diol::APNEA::CHEMBL326958::ChEMBL_198532

SMILES Nc1ccc(CCNc2ncnc3n(cnc23)C2OC(CO)C(O)C2O)cc1

InChI Key InChIKey=XTPOZVLRZZIEBW-UHFFFAOYSA-N

Data  2 KI

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 = 50037785   

TargetAdenosine receptor A1(Oryctolagus cuniculus (Rabbit))
Pfizer Inc

Curated by PDSP Ki Database
LigandPNGBDBM50037785(2-(6-{[2-(4-aminophenyl)ethyl]amino}-9H-purin-9-yl...)
Show SMILES Nc1ccc(CCNc2ncnc3n(cnc23)C2OC(CO)C(O)C2O)cc1
Show InChI InChI=1S/C18H22N6O4/c19-11-3-1-10(2-4-11)5-6-20-16-13-17(22-8-21-16)24(9-23-13)18-15(27)14(26)12(7-25)28-18/h1-4,8-9,12,14-15,18,25-27H,5-7,19H2,(H,20,21,22)
In DepthDetails PubMed
TargetAdenosine receptor A3(Oryctolagus cuniculus (rabbit))
Pfizer Inc

Curated by PDSP Ki Database
LigandPNGBDBM50037785(2-(6-{[2-(4-aminophenyl)ethyl]amino}-9H-purin-9-yl...)
Show SMILES Nc1ccc(CCNc2ncnc3n(cnc23)C2OC(CO)C(O)C2O)cc1
Show InChI InChI=1S/C18H22N6O4/c19-11-3-1-10(2-4-11)5-6-20-16-13-17(22-8-21-16)24(9-23-13)18-15(27)14(26)12(7-25)28-18/h1-4,8-9,12,14-15,18,25-27H,5-7,19H2,(H,20,21,22)
Affinity DataKi:  47nMMore data for this Ligand-Target Pair
In DepthDetails PubMed