null

SMILES: Nc1nnc(-c2cc(Cl)nc(c2)C(F)(F)F)c(n1)-c1ccc(F)cc1

InChI Key: InChIKey=LGWZYEYBDVFUJX-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 493765   

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 A2a (Homo sapiens (Human))	BDBM493765 (US10988455, Example 1(clxix)) Show SMILES Nc1nnc(-c2cc(Cl)nc(c2)C(F)(F)F)c(n1)-c1ccc(F)cc1 Show InChI InChI=1S/C15H8ClF4N5/c16-11-6-8(5-10(22-11)15(18,19)20)13-12(23-14(21)25-24-13)7-1-3-9(17)4-2-7/h1-6H,(H2,21,23,25)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	3.98	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Heptares Therapeutics Limited US Patent					Assay Description All test compounds were prepared as a stock solution of 10 mM in 100% DMSO.Inhibition binding assays were performed using 2.5 μg of membranes pr...				US Patent US10988455 (2021)
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Homo sapiens (Human))	BDBM493765 (US10988455, Example 1(clxix)) Show SMILES Nc1nnc(-c2cc(Cl)nc(c2)C(F)(F)F)c(n1)-c1ccc(F)cc1 Show InChI InChI=1S/C15H8ClF4N5/c16-11-6-8(5-10(22-11)15(18,19)20)13-12(23-14(21)25-24-13)7-1-3-9(17)4-2-7/h1-6H,(H2,21,23,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	102	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Heptares Therapeutics Limited US Patent					Assay Description All test compounds were prepared as a stock solution of 10 mM in 100% DMSO.Inhibition binding assays were performed using 2.5 μg of membranes pr...				US Patent US10988455 (2021)
					More data for this Ligand-Target Pair