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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Voltage-dependent L-type calcium channel subunit alpha-1C' and Ligand = 'BDBM164311'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Voltage-dependent L-type calcium channel subunit alpha-1C


(Homo sapiens (Human))
BDBM164311
PNG
(US9688615, 122)
Show SMILES CC(C)(C)NC(=O)Cn1c(CC2CCNCC2)nc2cc(Cl)c(Cl)cc12
Show InChI InChI=1S/C19H26Cl2N4O/c1-19(2,3)24-18(26)11-25-16-10-14(21)13(20)9-15(16)23-17(25)8-12-4-6-22-7-5-12/h9-10,12,22H,4-8,11H2,1-3H3,(H,24,26)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a>1.00E+4n/an/an/an/a7.4n/a



SRMLSC

US Patent


Assay Description
To assess the potential cardiac liability of compounds at an early stage in the drug discovery process, a Nav1.5 sodium channel screening assay was b...


US Patent US9688615 (2017)


BindingDB Entry DOI: 10.7270/Q27S7KXH
More data for this
Ligand-Target Pair
Voltage-dependent L-type calcium channel subunit alpha-1C


(Homo sapiens (Human))
BDBM164311
PNG
(US9688615, 122)
Show SMILES CC(C)(C)NC(=O)Cn1c(CC2CCNCC2)nc2cc(Cl)c(Cl)cc12
Show InChI InChI=1S/C19H26Cl2N4O/c1-19(2,3)24-18(26)11-25-16-10-14(21)13(20)9-15(16)23-17(25)8-12-4-6-22-7-5-12/h9-10,12,22H,4-8,11H2,1-3H3,(H,24,26)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a>1.00E+4n/an/an/an/a7.4n/a



SRMLSC

US Patent


Assay Description
To assess the potential cardiac liability of compounds at an early stage in the drug discovery process, a Nav1.5 sodium channel screening assay was b...


US Patent US9688615 (2017)


BindingDB Entry DOI: 10.7270/Q27S7KXH
More data for this
Ligand-Target Pair