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Compile Data Set for Download or QSAR

Found 3 hits of ki for UniProtKB: P00442   
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
Superoxide dismutase [Cu-Zn]


(Bos taurus (Cattle))
BDBM241955
PNG
(Aβ (1-40) | DAEFRHDSGYEVHHQKLVFFAEDVGSNKGAIIG...)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](C)NC(=O)[C@@H](N)CC(O)=O)C(C)C)C(C)C)C(C)C)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C(C)C)C(=O)NCC(=O)NCC(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C(C)C)C(O)=O |r|
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
Article
PubMed
1.17E+4n/an/an/an/an/an/an/an/a



Rhodes University



Assay Description
Purified SOD from bovine brain (20 μl) was incubated (37°C, 60 min) with Aβ25-37, Aβ29-33 or Aβ1-40 (20 μl, 5 μM) follo...


J Enzyme Inhib Med Chem 28: 727-33 (2013)


Article DOI: 10.3109/14756366.2012.680063
BindingDB Entry DOI: 10.7270/Q2JM28KG
More data for this
Ligand-Target Pair
Superoxide dismutase [Cu-Zn]


(Bos taurus (Cattle))
BDBM241954
PNG
(Aβ (29-33) | GAIIG)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)CN)[C@@H](C)CC)C(=O)NCC(O)=O |r|
Show InChI InChI=1S/C19H35N5O6/c1-6-10(3)15(18(29)21-9-14(26)27)24-19(30)16(11(4)7-2)23-17(28)12(5)22-13(25)8-20/h10-12,15-16H,6-9,20H2,1-5H3,(H,21,29)(H,22,25)(H,23,28)(H,24,30)(H,26,27)/t10-,11-,12-,15-,16-/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
1.32E+4n/an/an/an/an/an/an/an/a



Rhodes University



Assay Description
Purified SOD from bovine brain (20 μl) was incubated (37°C, 60 min) with Aβ25-37, Aβ29-33 or Aβ1-40 (20 μl, 5 μM) follo...


J Enzyme Inhib Med Chem 28: 727-33 (2013)


Article DOI: 10.3109/14756366.2012.680063
BindingDB Entry DOI: 10.7270/Q2JM28KG
More data for this
Ligand-Target Pair
Superoxide dismutase [Cu-Zn]


(Bos taurus (Cattle))
BDBM241953
PNG
(Aβ (25-37) | GSNKGAIIGLMVG)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CO)NC(=O)CN)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(=O)N[C@@H](C(C)C)C(=O)NCC(O)=O |r|
Show InChI InChI=1S/C52H93N15O16S/c1-11-28(7)42(51(82)57-23-39(72)60-33(19-26(3)4)47(78)63-32(16-18-84-10)46(77)65-41(27(5)6)50(81)58-24-40(73)74)67-52(83)43(29(8)12-2)66-44(75)30(9)59-38(71)22-56-45(76)31(15-13-14-17-53)62-48(79)34(20-36(55)69)64-49(80)35(25-68)61-37(70)21-54/h26-35,41-43,68H,11-25,53-54H2,1-10H3,(H2,55,69)(H,56,76)(H,57,82)(H,58,81)(H,59,71)(H,60,72)(H,61,70)(H,62,79)(H,63,78)(H,64,80)(H,65,77)(H,66,75)(H,67,83)(H,73,74)/t28-,29-,30-,31-,32-,33-,34-,35-,41-,42-,43-/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
1.44E+4n/an/an/an/an/an/an/an/a



Rhodes University



Assay Description
Purified SOD from bovine brain (20 μl) was incubated (37°C, 60 min) with Aβ25-37, Aβ29-33 or Aβ1-40 (20 μl, 5 μM) follo...


J Enzyme Inhib Med Chem 28: 727-33 (2013)


Article DOI: 10.3109/14756366.2012.680063
BindingDB Entry DOI: 10.7270/Q2JM28KG
More data for this
Ligand-Target Pair