BindingDB logo
myBDB logout

BDBM140577 US8912224, 6

SMILES: CC(NC(=O)c1cnc(Oc2ccc3OC(CCc3c2)c2ccccc2)s1)c1ccncc1

InChI Key: InChIKey=KZBVEHVPUXEIQG-UHFFFAOYNA-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 = 140577   
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/calcium exchanger 1(NCX1)


(Homo sapiens (Human))
BDBM140577
PNG
(US8912224, 6)
Show SMILES CC(NC(=O)c1cnc(Oc2ccc3OC(CCc3c2)c2ccccc2)s1)c1ccncc1
Show InChI InChI=1/C26H23N3O3S/c1-17(18-11-13-27-14-12-18)29-25(30)24-16-28-26(33-24)31-21-8-10-23-20(15-21)7-9-22(32-23)19-5-3-2-4-6-19/h2-6,8,10-17,22H,7,9H2,1H3,(H,29,30)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 400n/an/an/an/an/an/a



Sanofi

US Patent


Assay Description
The assay is based on the monitoring of intracellular Ca2+concentrations using the calcium-sensitive dye Fluo-4. CHO cells expressing NCX1 were loade...


US Patent US8912224 (2014)


BindingDB Entry DOI: 10.7270/Q22F7M52
More data for this
Ligand-Target Pair