BDBM50176820 4-butyl-5-(4-cyclopropylbut-1-en-2-yl)-1-(2-phenylpropyl)-1H-indene::CHEMBL375885

SMILES: CCCNc1c(cnc2n(CC(Cl)c3ccccc3)ncc12)C(=O)OCC1CC1

InChI Key: InChIKey=XZENHENQIZXPLF-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 = 50176820   

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 A1 receptor (BOVINE)	BDBM50176820 (4-butyl-5-(4-cyclopropylbut-1-en-2-yl)-1-(2-phenyl...) Show SMILES CCCNc1c(cnc2n(CC(Cl)c3ccccc3)ncc12)C(=O)OCC1CC1 Show InChI InChI=1S/C22H25ClN4O2/c1-2-10-24-20-17-12-26-27(13-19(23)16-6-4-3-5-7-16)21(17)25-11-18(20)22(28)29-14-15-8-9-15/h3-7,11-12,15,19H,2,8-10,13-14H2,1H3,(H,24,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	109	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università degli Studi di Siena Curated by ChEMBL					Assay Description Displacement of [3H]DPCPX from adenosine A1 receptor in bovine cerebral cortical membranes				J Med Chem 48: 7172-85 (2005) Article DOI: 10.1021/jm050407k BindingDB Entry DOI: 10.7270/Q2N0163Q
					More data for this Ligand-Target Pair