BDBM50294500 2-amino-N-((6-aminopyridin-2-yl)methyl)-6-(furan-2-yl)pyrimidine-4-carboxamide::CHEMBL551373

SMILES: Nc1cccc(CNC(=O)c2cc(nc(N)n2)-c2ccco2)n1

InChI Key: InChIKey=MPXGXZJPDNLULM-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50294500   

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))	BDBM50294500 (2-amino-N-((6-aminopyridin-2-yl)methyl)-6-(furan-2...) Show SMILES Nc1cccc(CNC(=O)c2cc(nc(N)n2)-c2ccco2)n1 Show InChI InChI=1S/C15H14N6O2/c16-13-5-1-3-9(19-13)8-18-14(22)11-7-10(20-15(17)21-11)12-4-2-6-23-12/h1-7H,8H2,(H2,16,19)(H,18,22)(H2,17,20,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	7	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Vernalis (R+D) Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]CGS21680 from human adenosine A2A receptor				Bioorg Med Chem Lett 19: 2664-7 (2009) Article DOI: 10.1016/j.bmcl.2009.03.142 BindingDB Entry DOI: 10.7270/Q2RF5V1M
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Homo sapiens (Human))	BDBM50294500 (2-amino-N-((6-aminopyridin-2-yl)methyl)-6-(furan-2...) Show SMILES Nc1cccc(CNC(=O)c2cc(nc(N)n2)-c2ccco2)n1 Show InChI InChI=1S/C15H14N6O2/c16-13-5-1-3-9(19-13)8-18-14(22)11-7-10(20-15(17)21-11)12-4-2-6-23-12/h1-7H,8H2,(H2,16,19)(H,18,22)(H2,17,20,21)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	131	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Vernalis (R+D) Ltd. Curated by ChEMBL					Assay Description Displacement of [3H]CGS21680 from human adenosine A1 receptor				Bioorg Med Chem Lett 19: 2664-7 (2009) Article DOI: 10.1016/j.bmcl.2009.03.142 BindingDB Entry DOI: 10.7270/Q2RF5V1M
					More data for this Ligand-Target Pair
Adenosine receptor A2b (Homo sapiens (Human))	BDBM50294500 (2-amino-N-((6-aminopyridin-2-yl)methyl)-6-(furan-2...) Show SMILES Nc1cccc(CNC(=O)c2cc(nc(N)n2)-c2ccco2)n1 Show InChI InChI=1S/C15H14N6O2/c16-13-5-1-3-9(19-13)8-18-14(22)11-7-10(20-15(17)21-11)12-4-2-6-23-12/h1-7H,8H2,(H2,16,19)(H,18,22)(H2,17,20,21)	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	444	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Vernalis (R+D) Ltd. Curated by ChEMBL					Assay Description Binding affinity to adenosine A2B receptor				Bioorg Med Chem Lett 19: 2664-7 (2009) Article DOI: 10.1016/j.bmcl.2009.03.142 BindingDB Entry DOI: 10.7270/Q2RF5V1M
					More data for this Ligand-Target Pair
Adenosine receptor A3 (Homo sapiens (Human))	BDBM50294500 (2-amino-N-((6-aminopyridin-2-yl)methyl)-6-(furan-2...) Show SMILES Nc1cccc(CNC(=O)c2cc(nc(N)n2)-c2ccco2)n1 Show InChI InChI=1S/C15H14N6O2/c16-13-5-1-3-9(19-13)8-18-14(22)11-7-10(20-15(17)21-11)12-4-2-6-23-12/h1-7H,8H2,(H2,16,19)(H,18,22)(H2,17,20,21)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	1.48E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Vernalis (R+D) Ltd. Curated by ChEMBL					Assay Description Binding affinity to adenosine A3 receptor				Bioorg Med Chem Lett 19: 2664-7 (2009) Article DOI: 10.1016/j.bmcl.2009.03.142 BindingDB Entry DOI: 10.7270/Q2RF5V1M
					More data for this Ligand-Target Pair