BDBM50034171 3,4-Dihydroxy-5-[6-(3-iodo-benzylamino)-purin-9-yl]-tetrahydro-furan-2-carboxylic acid methylamide::3,4-dihydroxy-5-(6-{[(3-iodophenyl)methyl]amino}-9H-purin-9-yl)-N-methyloxolane-2-carboxamide::IB-MECA

SMILES CNC(=O)C1OC(C(O)C1O)n1cnc2c(NCc3cccc(I)c3)ncnc12

InChI Key InChIKey=HUJXGQILHAUCCV-UHFFFAOYSA-N

Data  11 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 11 hits for monomerid = 50034171   

TargetAdenosine receptor A3(Human)
University of Ferrara

Curated by PDSP Ki Database
LigandPNGBDBM50034171(3,4-dihydroxy-5-(6-{[(3-iodophenyl)methyl]amino}-9...)
Affinity DataKi:  1.20nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/17/2012
Entry Details
PubMed
TargetAdenosine receptor A3(Human)
University of Ferrara

Curated by PDSP Ki Database
LigandPNGBDBM50034171(3,4-dihydroxy-5-(6-{[(3-iodophenyl)methyl]amino}-9...)
Affinity DataKi:  1.20nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/3/2012
Entry Details Article
PubMed
TargetAdenosine receptor A3(Rabbit)
Pfizer

Curated by PDSP Ki Database
LigandPNGBDBM50034171(3,4-dihydroxy-5-(6-{[(3-iodophenyl)methyl]amino}-9...)
In Depth
Date in BDB:
2/24/2012
Entry Details
PubMed
TargetAdenosine receptor A3(Chicken)
University of Illinois At Chicago

Curated by PDSP Ki Database
LigandPNGBDBM50034171(3,4-dihydroxy-5-(6-{[(3-iodophenyl)methyl]amino}-9...)
Affinity DataKi:  2.80nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/30/2012
Entry Details Article
PubMed
TargetAdenosine receptor A1(Chicken)
University of Illinois At Chicago

Curated by PDSP Ki Database
LigandPNGBDBM50034171(3,4-dihydroxy-5-(6-{[(3-iodophenyl)methyl]amino}-9...)
Affinity DataKi:  16.3nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/30/2012
Entry Details Article
PubMed
TargetAdenosine receptor A1(Rabbit)
Pfizer

Curated by PDSP Ki Database
LigandPNGBDBM50034171(3,4-dihydroxy-5-(6-{[(3-iodophenyl)methyl]amino}-9...)
Affinity DataKi:  30nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
2/24/2012
Entry Details
PubMed
TargetAdenosine receptor A3(Human)
University of Ferrara

Curated by PDSP Ki Database
LigandPNGBDBM50034171(3,4-dihydroxy-5-(6-{[(3-iodophenyl)methyl]amino}-9...)
Affinity DataKi:  80nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/17/2012
Entry Details
PubMed
TargetAdenosine receptor A3(Human)
University of Ferrara

Curated by PDSP Ki Database
LigandPNGBDBM50034171(3,4-dihydroxy-5-(6-{[(3-iodophenyl)methyl]amino}-9...)
Affinity DataKi:  103nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/3/2012
Entry Details Article
PubMed
TargetAdenosine receptor A3(Human)
University of Ferrara

Curated by PDSP Ki Database
LigandPNGBDBM50034171(3,4-dihydroxy-5-(6-{[(3-iodophenyl)methyl]amino}-9...)
Affinity DataKi:  110nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/3/2012
Entry Details Article
PubMed
TargetAdenosine receptor A2a(Human)
UniversitÄT WÜRzburg

Curated by PDSP Ki Database
LigandPNGBDBM50034171(3,4-dihydroxy-5-(6-{[(3-iodophenyl)methyl]amino}-9...)
Affinity DataKi:  2.52E+3nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/3/2012
Entry Details Article
PubMed
TargetAdenosine receptor A2b(Human)
University of Virginia

Curated by PDSP Ki Database
LigandPNGBDBM50034171(3,4-dihydroxy-5-(6-{[(3-iodophenyl)methyl]amino}-9...)
Affinity DataKi: >1.00E+4nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/13/2012
Entry Details
PubMed