BDBM161046 US9108947, 21

SMILES: Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC(C)(CNc2ccc(cn2)[N+]#[C-])C1

InChI Key: InChIKey=JLDCPFISZBXTIL-AJZOCDQUSA-N

Data: 1 IC50

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 = 161046   

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
ATP-sensitive inward rectifier potassium channel 1 (Homo sapiens (Human))	BDBM161046 (US9108947, 21) Show SMILES Cc1c2COC(=O)c2ccc1[C@@H](O)CN1CCC(C)(CNc2ccc(cn2)[N+]#[C-])C1 |r| Show InChI InChI=1S/C23H26N4O3/c1-15-17(5-6-18-19(15)12-30-22(18)29)20(28)11-27-9-8-23(2,14-27)13-26-21-7-4-16(24-3)10-25-21/h4-7,10,20,28H,8-9,11-14H2,1-2H3,(H,25,26)/t20-,23?/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	103	n/a	n/a	n/a	n/a	7.4	37
Merck Sharp & Dohme Corp. US Patent					Assay Description Block of Kir1.1 (ROMK1) currents was examined by whole cell voltage clamp (Hamill et. al. Pfluegers Archives 391:85-100 (1981)) using the IonWorks.RT...				US Patent US9108947 (2015) BindingDB Entry DOI: 10.7270/Q2V40SZT
					More data for this Ligand-Target Pair