BDBM21242 (2S,3S,4R,5R)-5-(6-{[(4-aminophenyl)methyl]amino}-9H-purin-9-yl)-3,4-dihydroxy-N-methyloxolane-2-carboxamide::AB-MECA::N(6)-(4-amino-3-iodobenzyl)adenosine-5-N-methyluronamide::[3H]AB-MECA

SMILES: CNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(NCc3ccc(N)cc3)ncnc12

InChI Key: InChIKey=LDYMCRRFCMRFKB-UHFFFAOYSA-N

Data: 5 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 21242   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Adenosine receptor A3 (Rat)	BDBM21242 (AB-MECA | N(6)-(4-amino-3-iodobenzyl)adenosine-5-N...) Show SMILES Show InChI	GoogleScholar	UniChem		14	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Human)	BDBM21242 (AB-MECA | N(6)-(4-amino-3-iodobenzyl)adenosine-5-N...) Show SMILES Show InChI	GoogleScholar	UniChem		18	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Human)	BDBM21242 (AB-MECA | N(6)-(4-amino-3-iodobenzyl)adenosine-5-N...) Show SMILES Show InChI	GoogleScholar	UniChem		21.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Rat)	BDBM21242 (AB-MECA | N(6)-(4-amino-3-iodobenzyl)adenosine-5-N...) Show SMILES Show InChI	GoogleScholar	UniChem		431	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Human)	BDBM21242 (AB-MECA | N(6)-(4-amino-3-iodobenzyl)adenosine-5-N...) Show SMILES Show InChI	GoogleScholar	UniChem		435	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair