BDBM50473879 CHEMBL2111818

SMILES: [H][C@]12Cc3c(O)cccc3C(C)(CCN1C[C@@H](C)OCC1CCCCC1)C2(C)C

InChI Key: InChIKey=KSNZMMWYIDINFT-QQYUOCJXSA-N

Data: 1 KI  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 2 hits for monomerid = 50473879   

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 1/2/3 subunit alpha (Rattus norvegicus)	BDBM50473879 (CHEMBL2111818) Show SMILES [H][C@]12Cc3c(O)cccc3C(C)(CCN1C[C@@H](C)OCC1CCCCC1)C2(C)C |THB:15:14:26:9.3.2,8:9:26:14.12.13| Show InChI InChI=1S/C25H39NO2/c1-18(28-17-19-9-6-5-7-10-19)16-26-14-13-25(4)21-11-8-12-22(27)20(21)15-23(26)24(25,2)3/h8,11-12,18-19,23,27H,5-7,9-10,13-17H2,1-4H3/t18-,23-,25?/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	241	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharma KG Curated by ChEMBL					Assay Description Displacement of [3H]BTX from sodium channel of rat cerebral cortex synaptosomes				J Med Chem 45: 3755-64 (2002) Article DOI: 10.1021/jm020875j BindingDB Entry DOI: 10.7270/Q2ZS308Z
					More data for this Ligand-Target Pair
Sodium channel protein type 1/2/3 subunit alpha (Rattus norvegicus)	BDBM50473879 (CHEMBL2111818) Show SMILES [H][C@]12Cc3c(O)cccc3C(C)(CCN1C[C@@H](C)OCC1CCCCC1)C2(C)C |THB:15:14:26:9.3.2,8:9:26:14.12.13| Show InChI InChI=1S/C25H39NO2/c1-18(28-17-19-9-6-5-7-10-19)16-26-14-13-25(4)21-11-8-12-22(27)20(21)15-23(26)24(25,2)3/h8,11-12,18-19,23,27H,5-7,9-10,13-17H2,1-4H3/t18-,23-,25?/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.48E+3	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharma KG Curated by ChEMBL					Assay Description Inhibitory effect against veratridine-induced glutamate release from rat brain slices				J Med Chem 45: 3755-64 (2002) Article DOI: 10.1021/jm020875j BindingDB Entry DOI: 10.7270/Q2ZS308Z
					More data for this Ligand-Target Pair