BDBM493756 US10988455, Example 1(xc)

SMILES: Cc1cc(cc(Cl)n1)-c1nnc(N)nc1-c1cccc(F)c1

InChI Key: InChIKey=NORPSLFVKUSIOR-UHFFFAOYSA-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 = 493756   

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))	BDBM493756 (US10988455, Example 1(xc)) Show SMILES Cc1cc(cc(Cl)n1)-c1nnc(N)nc1-c1cccc(F)c1 Show InChI InChI=1S/C15H11ClFN5/c1-8-5-10(7-12(16)19-8)14-13(20-15(18)22-21-14)9-3-2-4-11(17)6-9/h2-7H,1H3,(H2,18,20,22)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	8.51	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))	BDBM493756 (US10988455, Example 1(xc)) Show SMILES Cc1cc(cc(Cl)n1)-c1nnc(N)nc1-c1cccc(F)c1 Show InChI InChI=1S/C15H11ClFN5/c1-8-5-10(7-12(16)19-8)14-13(20-15(18)22-21-14)9-3-2-4-11(17)6-9/h2-7H,1H3,(H2,18,20,22)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	55	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