BDBM50366489 CHEMBL611882

SMILES: OC[C@H](Cc1ccccc1)Nc1nc(I)nc2n(cnc12)C1O[C@H](CO)[C@@H](O)[C@H]1O

InChI Key: InChIKey=MAEGRIICEOKVOO-JOXGBPAOSA-N

Data: 2 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 2 hits for monomerid = 50366489   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Adenosine receptor A1 (Rattus norvegicus (rat))	BDBM50366489 (CHEMBL611882) Show SMILES OC[C@H](Cc1ccccc1)Nc1nc(I)nc2n(cnc12)C1O[C@H](CO)[C@@H](O)[C@H]1O |r| Show InChI InChI=1S/C19H22IN5O5/c20-19-23-16(22-11(7-26)6-10-4-2-1-3-5-10)13-17(24-19)25(9-21-13)18-15(29)14(28)12(8-27)30-18/h1-5,9,11-12,14-15,18,26-29H,6-8H2,(H,22,23,24)/t11-,12+,14+,15+,18?/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	23	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Binding affinity at Adenosine A1 receptor in rat brain membranes by [3H](R)-PIA displacement.				Bioorg Med Chem Lett 7: 3085-3090 (1997) Article DOI: 10.1016/S0960-894X(97)10177-9 BindingDB Entry DOI: 10.7270/Q2SQ90W2
					More data for this Ligand-Target Pair
Adenosine Receptors A2a (A2a) (Rattus norvegicus (rat))	BDBM50366489 (CHEMBL611882) Show SMILES OC[C@H](Cc1ccccc1)Nc1nc(I)nc2n(cnc12)C1O[C@H](CO)[C@@H](O)[C@H]1O |r| Show InChI InChI=1S/C19H22IN5O5/c20-19-23-16(22-11(7-26)6-10-4-2-1-3-5-10)13-17(24-19)25(9-21-13)18-15(29)14(28)12(8-27)30-18/h1-5,9,11-12,14-15,18,26-29H,6-8H2,(H,22,23,24)/t11-,12+,14+,15+,18?/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	1.36E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Displacement of [3H]-CGS- 21680 from Adenosine A2 receptor of rat striatal membranes				Bioorg Med Chem Lett 7: 3085-3090 (1997) Article DOI: 10.1016/S0960-894X(97)10177-9 BindingDB Entry DOI: 10.7270/Q2SQ90W2
					More data for this Ligand-Target Pair