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Compile Data Set for Download or QSAR

Found 2 hits with Last Name = 'alvarez-manzaneda' and Initial = 'ej'   
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
Superoxide dismutase [Cu-Zn]


(Homo sapiens (Human))
BDBM50039027
PNG
(CHEMBL3355357)
Show SMILES [H][C@@]12[C@@H](O)C(=O)c3cc(C(C)C)c(O)cc3[C@@]1(C)CCC[C@@]2(C)CO |r|
Show InChI InChI=1S/C20H28O4/c1-11(2)12-8-13-14(9-15(12)22)20(4)7-5-6-19(3,10-21)18(20)17(24)16(13)23/h8-9,11,17-18,21-22,24H,5-7,10H2,1-4H3/t17-,18-,19-,20+/m0/s1
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 5.66E+4n/an/an/an/an/an/a



University of Granada

Curated by ChEMBL


Assay Description
Inhibition of CuZn-SOD in human erythrocytes


Eur J Med Chem 89: 683-90 (2014)


Article DOI: 10.1016/j.ejmech.2014.11.004
BindingDB Entry DOI: 10.7270/Q2HQ41JM
More data for this
Ligand-Target Pair
Superoxide dismutase [Cu-Zn]


(Homo sapiens (Human))
BDBM50039031
PNG
(CHEMBL3355358)
Show SMILES [H][C@@]12CCc3cc(O)ccc3[C@@]1(C)CCC[C@@]2(C)C(=O)OC |r|
Show InChI InChI=1S/C18H24O3/c1-17-9-4-10-18(2,16(20)21-3)15(17)8-5-12-11-13(19)6-7-14(12)17/h6-7,11,15,19H,4-5,8-10H2,1-3H3/t15-,17-,18-/m1/s1
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PC cid
PC sid
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Similars

Article
PubMed
n/an/a 5.89E+4n/an/an/an/an/an/a



University of Granada

Curated by ChEMBL


Assay Description
Inhibition of CuZn-SOD in human erythrocytes


Eur J Med Chem 89: 683-90 (2014)


Article DOI: 10.1016/j.ejmech.2014.11.004
BindingDB Entry DOI: 10.7270/Q2HQ41JM
More data for this
Ligand-Target Pair