BDBM50275695 CHEMBL506129::N-(6-(3-cyanophenyl)-2-(3,5-dimethyl-1H-pyrazol-1-yl)pyrimidin-4-yl)acetamide

SMILES: CC(=O)Nc1cc(nc(n1)-n1nc(C)cc1C)-c1cccc(c1)C#N

InChI Key: InChIKey=RLYMKXCOCBLPDC-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 = 50275695   

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))	BDBM50275695 (CHEMBL506129 | N-(6-(3-cyanophenyl)-2-(3,5-dimethy...) Show SMILES CC(=O)Nc1cc(nc(n1)-n1nc(C)cc1C)-c1cccc(c1)C#N Show InChI InChI=1S/C18H16N6O/c1-11-7-12(2)24(23-11)18-21-16(9-17(22-18)20-13(3)25)15-6-4-5-14(8-15)10-19/h4-9H,1-3H3,(H,20,21,22,25)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Neurocrine Biosciences Curated by ChEMBL					Assay Description Displacement of [3H]ZM241385 from human adenosine A2A receptor expressed in HEK293 cells				Bioorg Med Chem Lett 18: 5402-5 (2008) Article DOI: 10.1016/j.bmcl.2008.09.048 BindingDB Entry DOI: 10.7270/Q28K78ZG
					More data for this Ligand-Target Pair