BDBM50118110 CHEMBL3613449

SMILES: CCC(C)[C@@H](CN1CCC(C)(CC1)c1cccc(F)c1)NC(=O)[C@H]1Cc2ccc(O)cc2CN1

InChI Key: InChIKey=ZNIBWXZDUNBMBR-VTFDQJKESA-N

Data: 1 KI

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Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50118110   

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
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50118110 (CHEMBL3613449) Show SMILES CCC(C)[C@@H](CN1CCC(C)(CC1)c1cccc(F)c1)NC(=O)[C@H]1Cc2ccc(O)cc2CN1 |r| Show InChI InChI=1S/C28H38FN3O2/c1-4-19(2)26(31-27(34)25-15-20-8-9-24(33)14-21(20)17-30-25)18-32-12-10-28(3,11-13-32)22-6-5-7-23(29)16-22/h5-9,14,16,19,25-26,30,33H,4,10-13,15,17-18H2,1-3H3,(H,31,34)/t19?,25-,26-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.67E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Research Triangle Institute Curated by ChEMBL					Assay Description Displacement of [3H]-astemizole from human ERG				Bioorg Med Chem 23: 6379-88 (2015) BindingDB Entry DOI: 10.7270/Q2C24Z7Z
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