BDBM50100422 (1R,2S,4S,5S)-4-(6-Cyclopentylamino-purin-9-yl)-1-hydroxymethyl-bicyclo[3.1.0]hexan-2-ol::CHEMBL27502

SMILES OC[C@@]12C[C@@H]1[C@H](C[C@@H]2O)n1cnc2c(NC3CCCC3)ncnc12

InChI Key InChIKey=AKUOJWDGUSDCKF-XREXNNHRSA-N

Data  2 KI  1 EC50

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 = 50100422   

TargetAdenosine receptor A3(Homo sapiens (Human))
NIDDK

Curated by ChEMBL
LigandPNGBDBM50100422((1R,2S,4S,5S)-4-(6-Cyclopentylamino-purin-9-yl)-1-...)
Show SMILES OC[C@@]12C[C@@H]1[C@H](C[C@@H]2O)n1cnc2c(NC3CCCC3)ncnc12
Show InChI InChI=1S/C17H23N5O2/c23-7-17-6-11(17)12(5-13(17)24)22-9-20-14-15(18-8-19-16(14)22)21-10-3-1-2-4-10/h8-13,23-24H,1-7H2,(H,18,19,21)/t11-,12+,13+,17+/m1/s1
Affinity DataKi:  2.88E+3nMAssay Description:Ability to displace specific radioligand [125I]AB-MECA binding at human Adenosine A3 receptor expressed in CHO cellsMore data for this Ligand-Target Pair
TargetAdenosine receptor A1(Rattus norvegicus (rat))
NIDDK

Curated by ChEMBL
LigandPNGBDBM50100422((1R,2S,4S,5S)-4-(6-Cyclopentylamino-purin-9-yl)-1-...)
Show SMILES OC[C@@]12C[C@@H]1[C@H](C[C@@H]2O)n1cnc2c(NC3CCCC3)ncnc12
Show InChI InChI=1S/C17H23N5O2/c23-7-17-6-11(17)12(5-13(17)24)22-9-20-14-15(18-8-19-16(14)22)21-10-3-1-2-4-10/h8-13,23-24H,1-7H2,(H,18,19,21)/t11-,12+,13+,17+/m1/s1
Affinity DataKi:  5.11E+3nMAssay Description:Ability to displace specific radioligand [3H]R-PIA binding at Adenosine A1 receptor in rat brain membraneMore data for this Ligand-Target Pair
TargetAdenosine receptor A1(Homo sapiens (Human))
NIDDK

Curated by ChEMBL
LigandPNGBDBM50100422((1R,2S,4S,5S)-4-(6-Cyclopentylamino-purin-9-yl)-1-...)
Show SMILES OC[C@@]12C[C@@H]1[C@H](C[C@@H]2O)n1cnc2c(NC3CCCC3)ncnc12
Show InChI InChI=1S/C17H23N5O2/c23-7-17-6-11(17)12(5-13(17)24)22-9-20-14-15(18-8-19-16(14)22)21-10-3-1-2-4-10/h8-13,23-24H,1-7H2,(H,18,19,21)/t11-,12+,13+,17+/m1/s1
Affinity DataEC50:  2.89E+3nMAssay Description:Agonist efficacy as effective concentration to stimulate binding of [35S]GTP-gamma-S, at human A1 adenosine receptorMore data for this Ligand-Target Pair