BDBM50020316 CHEMBL3289177

SMILES: [H][C@]12CC[C@]([H])(C[C@@H](C1)NC(=O)c1ccc(s1)-c1cccs1)N2C

InChI Key: InChIKey=HOYMYBXHUOKEKJ-CLLJXQQHSA-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 = 50020316   

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
Neuronal acetylcholine receptor (Rattus norvegicus (Rat))	BDBM50020316 (CHEMBL3289177) Show SMILES [H][C@]12CC[C@]([H])(C[C@@H](C1)NC(=O)c1ccc(s1)-c1cccs1)N2C |r| Show InChI InChI=1S/C17H20N2OS2/c1-19-12-4-5-13(19)10-11(9-12)18-17(20)16-7-6-15(22-16)14-3-2-8-21-14/h2-3,6-8,11-13H,4-5,9-10H2,1H3,(H,18,20)/t11-,12+,13-	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	12	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ d'Orl£ans Curated by ChEMBL					Assay Description Displacement of [125I]-alpha-bungarotoxin from alpha7 nicotinic acetylcholine receptor in Wistar rat frontal cortex by gamma counting				Eur J Med Chem 82: 214-24 (2014) Article DOI: 10.1016/j.ejmech.2014.04.057 BindingDB Entry DOI: 10.7270/Q29888K4
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