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SMILES: [#6]-[#6](-[#6])-[#6]-[#6@H](-[#7]-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-1)-[#6](=O)-[#7]-1-[#6]-[#6]-[#6](-[#6]-[#6]-1)-[#7](-[#6]\[#6]=[#6](\[#6])-[#6])-c1ccc(-[#8]-[#6]-c2ccccc2)cc1

InChI Key: InChIKey=FAMHJXWXXPLHGU-UMSFTDKQSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50080314   
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
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM50080314
PNG
(Azepane-1-carboxylic acid ((S)-1-{4-[(4-benzyloxy-...)
Show SMILES [#6]-[#6](-[#6])-[#6]-[#6@H](-[#7]-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-1)-[#6](=O)-[#7]-1-[#6]-[#6]-[#6](-[#6]-[#6]-1)-[#7](-[#6]\[#6]=[#6](\[#6])-[#6])-c1ccc(-[#8]-[#6]-c2ccccc2)cc1
Show InChI InChI=1S/C36H52N4O3/c1-28(2)18-25-40(31-14-16-33(17-15-31)43-27-30-12-8-7-9-13-30)32-19-23-38(24-20-32)35(41)34(26-29(3)4)37-36(42)39-21-10-5-6-11-22-39/h7-9,12-18,29,32,34H,5-6,10-11,19-27H2,1-4H3,(H,37,42)/t34-/m0/s1
PDB

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PC sid
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Similars

PubMed
n/an/a 340n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research

Curated by ChEMBL


Assay Description
Inhibition of N-type Voltage Sensitive Calcium Channel (VSCC) using IMR-32 assay


Bioorg Med Chem Lett 9: 2453-8 (1999)


BindingDB Entry DOI: 10.7270/Q29K49FB
More data for this
Ligand-Target Pair
Voltage-dependent N-type calcium channel subunit alpha-1B


(Homo sapiens (Human))
BDBM50080314
PNG
(Azepane-1-carboxylic acid ((S)-1-{4-[(4-benzyloxy-...)
Show SMILES [#6]-[#6](-[#6])-[#6]-[#6@H](-[#7]-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6]-[#6]-[#6]-1)-[#6](=O)-[#7]-1-[#6]-[#6]-[#6](-[#6]-[#6]-1)-[#7](-[#6]\[#6]=[#6](\[#6])-[#6])-c1ccc(-[#8]-[#6]-c2ccccc2)cc1
Show InChI InChI=1S/C36H52N4O3/c1-28(2)18-25-40(31-14-16-33(17-15-31)43-27-30-12-8-7-9-13-30)32-19-23-38(24-20-32)35(41)34(26-29(3)4)37-36(42)39-21-10-5-6-11-22-39/h7-9,12-18,29,32,34H,5-6,10-11,19-27H2,1-4H3,(H,37,42)/t34-/m0/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 340n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of N-type calcium channels in IMR32 human neuroblastoma cells


J Med Chem 42: 4239-49 (1999)


BindingDB Entry DOI: 10.7270/Q2QF8S22
More data for this
Ligand-Target Pair