BDBM50391482 CHEMBL2147218
SMILES: Cc1ncc(cn1)-c1ccccc1CCNC(=O)c1cnc(OCCOCC(F)(F)F)c(C)c1
InChI Key: InChIKey=DZZDGFAFADZZQZ-UHFFFAOYSA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 2 hits for monomerid = 50391482 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 5 subunit alpha
(Homo sapiens (Human)) | BDBM50391482
(CHEMBL2147218)Show SMILES Cc1ncc(cn1)-c1ccccc1CCNC(=O)c1cnc(OCCOCC(F)(F)F)c(C)c1 Show InChI InChI=1S/C24H25F3N4O3/c1-16-11-19(12-31-23(16)34-10-9-33-15-24(25,26)27)22(32)28-8-7-18-5-3-4-6-21(18)20-13-29-17(2)30-14-20/h3-6,11-14H,7-10,15H2,1-2H3,(H,28,32) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | <3.16E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Inhibition of human Nav1.5 |
Bioorg Med Chem Lett 22: 6108-15 (2012)
Article DOI: 10.1016/j.bmcl.2012.08.031
BindingDB Entry DOI: 10.7270/Q2B8596S |
More data for this
Ligand-Target Pair | |
Sodium channel protein type 9 subunit alpha
(Homo sapiens (Human)) | BDBM50391482
(CHEMBL2147218)Show SMILES Cc1ncc(cn1)-c1ccccc1CCNC(=O)c1cnc(OCCOCC(F)(F)F)c(C)c1 Show InChI InChI=1S/C24H25F3N4O3/c1-16-11-19(12-31-23(16)34-10-9-33-15-24(25,26)27)22(32)28-8-7-18-5-3-4-6-21(18)20-13-29-17(2)30-14-20/h3-6,11-14H,7-10,15H2,1-2H3,(H,28,32) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
AstraZeneca
Curated by ChEMBL
| Assay Description
Inhibition of human Nav1.7 expressed in HEK293 cells by whole cell voltage-clamp electrophysiology assay |
Bioorg Med Chem Lett 22: 6108-15 (2012)
Article DOI: 10.1016/j.bmcl.2012.08.031
BindingDB Entry DOI: 10.7270/Q2B8596S |
More data for this
Ligand-Target Pair | |
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