BindingDB logo
myBDB logout

null

SMILES: Fc1cc(N[C@@H]2CCN(C2)c2ccccc2)c(Cl)cc1S(=O)(=O)Nc1nccs1

InChI Key: InChIKey=IXJXVJVVOXLEOM-CYBMUJFWSA-N

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 = 444514   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Sodium channel protein type 1 subunit alpha


(Homo sapiens (Human))
BDBM444514
PNG
((R)-4-(1-benzylpyrrolidin-3-ylamino)-5-chloro- 2-f...)
Show SMILES Fc1cc(N[C@@H]2CCN(C2)c2ccccc2)c(Cl)cc1S(=O)(=O)Nc1nccs1 |r|
Show InChI InChI=1S/C19H18ClFN4O2S2/c20-15-10-18(29(26,27)24-19-22-7-9-28-19)16(21)11-17(15)23-13-6-8-25(12-13)14-4-2-1-3-5-14/h1-5,7,9-11,13,23H,6,8,12H2,(H,22,24)/t13-/m1/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 2.87E+3n/an/an/an/an/an/a



Xenon Pharmaceuticals Inc.

US Patent


Assay Description
The following patch voltage clamp electrophysiology studies were performed on representative compounds of the invention using human embryonic kidney ...


US Patent US10662184 (2020)


BindingDB Entry DOI: 10.7270/Q2MK6GZP
More data for this
Ligand-Target Pair
Sodium channel protein type 8 subunit alpha


(Homo sapiens (Human))
BDBM444514
PNG
((R)-4-(1-benzylpyrrolidin-3-ylamino)-5-chloro- 2-f...)
Show SMILES Fc1cc(N[C@@H]2CCN(C2)c2ccccc2)c(Cl)cc1S(=O)(=O)Nc1nccs1 |r|
Show InChI InChI=1S/C19H18ClFN4O2S2/c20-15-10-18(29(26,27)24-19-22-7-9-28-19)16(21)11-17(15)23-13-6-8-25(12-13)14-4-2-1-3-5-14/h1-5,7,9-11,13,23H,6,8,12H2,(H,22,24)/t13-/m1/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 91n/an/an/an/an/an/a



Xenon Pharmaceuticals Inc.

US Patent


Assay Description
The following patch voltage clamp electrophysiology studies were performed on representative compounds of the invention using human embryonic kidney ...


US Patent US10662184 (2020)


BindingDB Entry DOI: 10.7270/Q2MK6GZP
More data for this
Ligand-Target Pair