BDBM50152092 2-Hydroxymethyl-5-{6-(3-iodo-benzylamino)-2-[4-(4-methoxy-phenyl)-pyrazol-1-yl]-purin-9-yl}-tetrahydro-furan-3,4-diol::CHEMBL361075

SMILES COc1ccc(cc1)-c1cnn(c1)-c1nc(NCc2cccc(I)c2)c2ncn(C3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1

InChI Key InChIKey=LHHKPNOHZCRPQI-UHFFFAOYSA-N

Data  3 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50152092   

TargetAdenosine receptor A3(Human)
Cv Therapeutics

Curated by ChEMBL
LigandPNGBDBM50152092(2-Hydroxymethyl-5-{6-(3-iodo-benzylamino)-2-[4-(4-...)
Affinity DataKi:  320nMAssay Description:Displacement of [125I]-AB MECA from recombinant human adenosine A3 receptor expressed in HEK cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/3/2012
Entry Details Article
PubMed
TargetAdenosine receptor A2a(Human)
Cv Therapeutics

Curated by ChEMBL
LigandPNGBDBM50152092(2-Hydroxymethyl-5-{6-(3-iodo-benzylamino)-2-[4-(4-...)
Affinity DataKi:  4.00E+3nMAssay Description:Displacement of [3H]CGS-21680 from recombinant human adenosine A2a receptor expressed in HEK cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/3/2012
Entry Details Article
PubMed
TargetAdenosine receptor A1(Human)
Cv Therapeutics

Curated by ChEMBL
LigandPNGBDBM50152092(2-Hydroxymethyl-5-{6-(3-iodo-benzylamino)-2-[4-(4-...)
Affinity DataKi:  4.50E+3nMAssay Description:Displacement of [3H]CCPA from recombinant human adenosine A1 receptor expressed in CHO cellsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/3/2012
Entry Details Article
PubMed