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2 similar compounds to monomer 50451202

Compile data set for download or QSAR
Wt: 425.9
BDBM50451205
Wt: 421.4
BDBM50451210

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50451205,50451210   
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-gated calcium channel subunit alpha Cav2.2


(Homo sapiens (Human))
BDBM50451210
PNG
(CHEMBL294369)
Show SMILES COc1cccc(COC(=O)[C@H](CC(=O)OC2CCCC2)NC(=O)OC(C)(C)C)c1
Show InChI InChI=1S/C22H31NO7/c1-22(2,3)30-21(26)23-18(13-19(24)29-16-9-5-6-10-16)20(25)28-14-15-8-7-11-17(12-15)27-4/h7-8,11-12,16,18H,5-6,9-10,13-14H2,1-4H3,(H,23,26)/t18-/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.80E+3n/an/an/an/an/an/a



no Pharmaceutical Co., Ltd.

Curated by ChEMBL


Assay Description
In vitro inhibition against N-type calcium influx in IMR-32 cells


Bioorg Med Chem Lett 11: 2067-70 (2001)


Article DOI: 10.1016/s0960-894x(01)00414-0
BindingDB Entry DOI: 10.7270/Q2HD7TX3
More data for this
Ligand-Target Pair
Voltage-gated calcium channel subunit alpha Cav2.2


(Homo sapiens (Human))
BDBM50451205
PNG
(CHEMBL293426)
Show SMILES CC(C)(C)OC(=O)N[C@@H](CC(=O)OC1CCCC1)C(=O)OCc1ccc(Cl)cc1
Show InChI InChI=1S/C21H28ClNO6/c1-21(2,3)29-20(26)23-17(12-18(24)28-16-6-4-5-7-16)19(25)27-13-14-8-10-15(22)11-9-14/h8-11,16-17H,4-7,12-13H2,1-3H3,(H,23,26)/t17-/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.30E+3n/an/an/an/an/an/a



no Pharmaceutical Co., Ltd.

Curated by ChEMBL


Assay Description
In vitro inhibition against N-type calcium influx in IMR-32 cells


Bioorg Med Chem Lett 11: 2067-70 (2001)


Article DOI: 10.1016/s0960-894x(01)00414-0
BindingDB Entry DOI: 10.7270/Q2HD7TX3
More data for this
Ligand-Target Pair