BDBM50269834 CHEMBL1807290

SMILES: C1CCC(CC1)Nc1c(nc2ccccn12)-c1ccccc1

InChI Key: InChIKey=ITAFYXQWMNSVLS-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 = 50269834   

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 (Rattus norvegicus (rat))	BDBM50269834 (CHEMBL1807290) Show SMILES C1CCC(CC1)Nc1c(nc2ccccn12)-c1ccccc1 Show InChI InChI=1S/C19H21N3/c1-3-9-15(10-4-1)18-19(20-16-11-5-2-6-12-16)22-14-8-7-13-17(22)21-18/h1,3-4,7-10,13-14,16,20H,2,5-6,11-12H2	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaceutical Chemistry, School of Pharmacy, North-West University, Private Bag X6001, Potchefstroom 2520, South Africa. Curated by ChEMBL					Assay Description Displacement of [3H]-DPCPX from A1 receptor in rat whole brain membrane				Bioorg Med Chem Lett 27: 3963-3967 (2017) Article DOI: 10.1016/j.bmcl.2017.07.071 BindingDB Entry DOI: 10.7270/Q2BZ68J4
					More data for this Ligand-Target Pair
Adenosine receptor A2a and A3 (Rattus norvegicus (rat))	BDBM50269834 (CHEMBL1807290) Show SMILES C1CCC(CC1)Nc1c(nc2ccccn12)-c1ccccc1 Show InChI InChI=1S/C19H21N3/c1-3-9-15(10-4-1)18-19(20-16-11-5-2-6-12-16)22-14-8-7-13-17(22)21-18/h1,3-4,7-10,13-14,16,20H,2,5-6,11-12H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaceutical Chemistry, School of Pharmacy, North-West University, Private Bag X6001, Potchefstroom 2520, South Africa. Curated by ChEMBL					Assay Description Displacement of [3H]-NECA from A2A receptor in rat striatal membrane in presence of A1 receptor agonist N6-cyclopentyladenosine				Bioorg Med Chem Lett 27: 3963-3967 (2017) Article DOI: 10.1016/j.bmcl.2017.07.071 BindingDB Entry DOI: 10.7270/Q2BZ68J4
					More data for this Ligand-Target Pair