BDBM236497 US9388137, 1

SMILES: Cc1cc(cc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(=O)NCC[N+]1(C)CCCCC1

InChI Key: InChIKey=FKMRWRIPRXOUKQ-UHFFFAOYSA-O

Data: 2 KI  2 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 4 hits for monomerid = 236497   

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
Sodium channel protein type 9 subunit alpha (Homo sapiens (Human))	BDBM236497 (US9388137, 1) Show SMILES Cc1cc(cc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(=O)NCC[N+]1(C)CCCCC1 Show InChI InChI=1S/C27H30FN3O2/c1-20-18-22(27(32)29-14-17-31(2)15-4-3-5-16-31)19-26(30-20)21-6-10-24(11-7-21)33-25-12-8-23(28)9-13-25/h6-13,18-19H,3-5,14-17H2,1-2H3/p+1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	6.03E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of human Nav1.7 expressed in HEK293 cells by electrophysiology method				Bioorg Med Chem Lett 24: 3690-9 (2014) Article DOI: 10.1016/j.bmcl.2014.06.038 BindingDB Entry DOI: 10.7270/Q2KS6VJM
					More data for this Ligand-Target Pair
Sodium channel protein type 9 subunit alpha (Homo sapiens (Human))	BDBM236497 (US9388137, 1) Show SMILES Cc1cc(cc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(=O)NCC[N+]1(C)CCCCC1 Show InChI InChI=1S/C27H30FN3O2/c1-20-18-22(27(32)29-14-17-31(2)15-4-3-5-16-31)19-26(30-20)21-6-10-24(11-7-21)33-25-12-8-23(28)9-13-25/h6-13,18-19H,3-5,14-17H2,1-2H3/p+1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	6.03E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Purdue Pharma L.P. US Patent					Assay Description On the day of experimentation, the 35 mm dish was placed on the stage of an inverted microscope equipped with a perfusion system that continuously pe...				US Patent US9388137 (2016) BindingDB Entry DOI: 10.7270/Q2542MG1
					More data for this Ligand-Target Pair
Sodium channel protein type 9 subunit alpha (Homo sapiens (Human))	BDBM236497 (US9388137, 1) Show SMILES Cc1cc(cc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(=O)NCC[N+]1(C)CCCCC1 Show InChI InChI=1S/C27H30FN3O2/c1-20-18-22(27(32)29-14-17-31(2)15-4-3-5-16-31)19-26(30-20)21-6-10-24(11-7-21)33-25-12-8-23(28)9-13-25/h6-13,18-19H,3-5,14-17H2,1-2H3/p+1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	872	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of human Nav1.7 expressed in HEK293 cells by FLIPR method				Bioorg Med Chem Lett 24: 3690-9 (2014) Article DOI: 10.1016/j.bmcl.2014.06.038 BindingDB Entry DOI: 10.7270/Q2KS6VJM
					More data for this Ligand-Target Pair
Sodium channel protein type 9 subunit alpha (Homo sapiens (Human))	BDBM236497 (US9388137, 1) Show SMILES Cc1cc(cc(n1)-c1ccc(Oc2ccc(F)cc2)cc1)C(=O)NCC[N+]1(C)CCCCC1 Show InChI InChI=1S/C27H30FN3O2/c1-20-18-22(27(32)29-14-17-31(2)15-4-3-5-16-31)19-26(30-20)21-6-10-24(11-7-21)33-25-12-8-23(28)9-13-25/h6-13,18-19H,3-5,14-17H2,1-2H3/p+1	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	872	n/a	n/a	n/a	n/a	7.3	n/a
Purdue Pharma L.P. US Patent					Assay Description The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL of 10× HBSS t...				US Patent US9388137 (2016) BindingDB Entry DOI: 10.7270/Q2542MG1
					More data for this Ligand-Target Pair