BDBM50393197 CHEMBL2153604

SMILES: Cn1c2nc3N(CCC4=CCCCC4)CCCCn3c2c(=O)n(C)c1=O

InChI Key: InChIKey=LKCSNKWGJJWMOM-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 = 50393197   

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 Receptors A2a (A2a) (Rattus norvegicus (rat))	BDBM50393197 (CHEMBL2153604) Show SMILES Cn1c2nc3N(CCC4=CCCCC4)CCCCn3c2c(=O)n(C)c1=O |t:8| Show InChI InChI=1S/C19H27N5O2/c1-21-16-15(17(25)22(2)19(21)26)24-12-7-6-11-23(18(24)20-16)13-10-14-8-4-3-5-9-14/h8H,3-7,9-13H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.17E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Jagiellonian University Medical College Curated by ChEMBL					Assay Description Displacement of [3H]MSX-2 from adenosine A2A receptor in rat brain striatal membrane				Eur J Med Chem 46: 3590-607 (2011) Article DOI: 10.1016/j.ejmech.2011.05.023 BindingDB Entry DOI: 10.7270/Q2ZC840S
					More data for this Ligand-Target Pair
Adenosine receptor A1 (Rattus norvegicus (rat))	BDBM50393197 (CHEMBL2153604) Show SMILES Cn1c2nc3N(CCC4=CCCCC4)CCCCn3c2c(=O)n(C)c1=O |t:8| Show InChI InChI=1S/C19H27N5O2/c1-21-16-15(17(25)22(2)19(21)26)24-12-7-6-11-23(18(24)20-16)13-10-14-8-4-3-5-9-14/h8H,3-7,9-13H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.66E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Jagiellonian University Medical College Curated by ChEMBL					Assay Description Displacement of [3H]CCPA from adenosine A1 receptor in rat brain cortical membrane				Eur J Med Chem 46: 3590-607 (2011) Article DOI: 10.1016/j.ejmech.2011.05.023 BindingDB Entry DOI: 10.7270/Q2ZC840S
					More data for this Ligand-Target Pair