BDBM303259 2-amino-8-methoxy-N- [(3-methyl-2- pyridyl)methyl]quinazoline- 4-carboxamide::US10138212, Example 24

SMILES: COc1cccc2c(nc(N)nc12)C(=O)NCc1ncccc1C

InChI Key: InChIKey=ICKIWYFJJCIZFQ-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 303259   

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))	BDBM303259 (2-amino-8-methoxy-N- [(3-methyl-2- pyridyl)methyl]...) Show SMILES COc1cccc2c(nc(N)nc12)C(=O)NCc1ncccc1C |$;;;;;;;;;;;;;;;HN;;;;;;;;$| Show InChI InChI=1S/C17H17N5O2/c1-10-5-4-8-19-12(10)9-20-16(23)15-11-6-3-7-13(24-2)14(11)21-17(18)22-15/h3-8H,9H2,1-2H3,(H,20,23)(H2,18,21,22)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.900	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Binding affinities of compounds of the invention for the human A2a receptor were determined in a competition binding assay using Scintillation Proxim...				US Patent US10138212 (2018) BindingDB Entry DOI: 10.7270/Q2WM1GGB
					More data for this Ligand-Target Pair