BDBM50080548 (2-Amino-4,5,6,7-tetrahydro-benzo[b]thiophen-3-yl)-(3-trifluoromethyl-phenyl)-methanone::CHEMBL332618

SMILES: Nc1sc2CCCCc2c1C(=O)c1cccc(c1)C(F)(F)F

InChI Key: InChIKey=CBUWQRLCBJTRCE-UHFFFAOYSA-N

Data: 1 EC50

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 = 50080548   

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 A1 (Rattus norvegicus (rat))	BDBM50080548 ((2-Amino-4,5,6,7-tetrahydro-benzo[b]thiophen-3-yl)...) Show SMILES Nc1sc2CCCCc2c1C(=O)c1cccc(c1)C(F)(F)F Show InChI InChI=1S/C16H14F3NOS/c17-16(18,19)10-5-3-4-9(8-10)14(21)13-11-6-1-2-7-12(11)22-15(13)20/h3-5,8H,1-2,6-7,20H2	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	6.00E+3	n/a	n/a	n/a	n/a
Leiden/Amsterdam Center for Drug Research Curated by ChEMBL					Assay Description Enhanced 0.5 nM [3H]-CCPA dissociation from adenosine A1 receptor of rat brain cortex membranes compared to 100 uM CPA				J Med Chem 42: 3629-35 (1999) Article DOI: 10.1021/jm991051d BindingDB Entry DOI: 10.7270/Q28K789Z
					More data for this Ligand-Target Pair