BDBM50317887 CHEMBL1094995::N6-[4-[2-[3,5-di-tert-butylbenzamido]ethyl]phenyl]adenosine-5'-N-methylcarboxamide

SMILES: CNC(=O)[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(Nc3ccc(CCNC(=O)c4cc(cc(c4)C(C)(C)C)C(C)(C)C)cc3)ncnc12

InChI Key: InChIKey=ORHQWTJAQBOXCQ-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50317887   

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 (Human)	BDBM50317887 (N6-[4-[2-[3,5-di-tert-butylbenzamido]ethyl]phenyl]...) Show SMILES Show InChI	GoogleScholar	UniChem		2.25	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Adenosine receptor A1 (Human)	BDBM50317887 (N6-[4-[2-[3,5-di-tert-butylbenzamido]ethyl]phenyl]...) Show SMILES Show InChI	GoogleScholar	UniChem		245	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Adenosine receptor A2a (Human)	BDBM50317887 (N6-[4-[2-[3,5-di-tert-butylbenzamido]ethyl]phenyl]...) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+4	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