BDBM50212229 CHEMBL3968649

SMILES: COc1cc(c(F)cc1-n1c2CCN(Cc2ccc1=O)S(=O)(=O)Nc1ncccn1)-c1cc(F)cc(Cl)c1

InChI Key: InChIKey=DDJGYBWMSXIWRU-UHFFFAOYSA-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 = 50212229   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Sodium channel protein type 9 subunit alpha (Homo sapiens (Human))	BDBM50212229 (CHEMBL3968649) Show SMILES COc1cc(c(F)cc1-n1c2CCN(Cc2ccc1=O)S(=O)(=O)Nc1ncccn1)-c1cc(F)cc(Cl)c1 Show InChI InChI=1S/C25H20ClF2N5O4S/c1-37-23-12-19(16-9-17(26)11-18(27)10-16)20(28)13-22(23)33-21-5-8-32(14-15(21)3-4-24(33)34)38(35,36)31-25-29-6-2-7-30-25/h2-4,6-7,9-13H,5,8,14H2,1H3,(H,29,30,31)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	28	n/a	n/a	n/a	n/a	n/a	n/a
Temple University Curated by ChEMBL					Assay Description Inhibition of human Nav1.7 expressed in HEK293 cells at holding potential yielding 20 to 50% inactivation measured after 3 mins by patchXpress electr...				ACS Med Chem Lett 8: 278-280 (2017) Article DOI: 10.1021/acsmedchemlett.7b00049 BindingDB Entry DOI: 10.7270/Q2QJ7KF5
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