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Compile Data Set for Download or QSAR

Found 6 hits with Last Name = 'ramírez-macias' and Initial = 'i'   
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))
BDBM50336560
PNG
(1,4-bis[3-(imidazol-1-yl)propylamino]benzo[g]phtha...)
Show SMILES C(CNc1nnc(NCCCn2ccnc2)c2cc3ccccc3cc12)Cn1ccnc1
Show InChI InChI=1S/C24H26N8/c1-2-6-20-16-22-21(15-19(20)5-1)23(27-7-3-11-31-13-9-25-17-31)29-30-24(22)28-8-4-12-32-14-10-26-18-32/h1-2,5-6,9-10,13-18H,3-4,7-8,11-12H2,(H,27,29)(H,28,30)
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Article
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n/an/a 6.79E+4n/an/an/an/an/an/a



Universidad de Granada

Curated by ChEMBL


Assay Description
Inhibition of human Cu-Zn superoxide dismutase assessed as inhibition of NADPH reduction


J Med Chem 54: 970-9 (2011)


Article DOI: 10.1021/jm101198k
BindingDB Entry DOI: 10.7270/Q24M94TW
More data for this
Ligand-Target Pair
Superoxide dismutase [Cu-Zn]


(Homo sapiens (Human))
BDBM50336562
PNG
(1,4-Bis(3'-pyrazolylamino)benzo[g]phthalazine | CH...)
Show SMILES N(c1ccn[nH]1)c1nnc(Nc2ccn[nH]2)c2cc3ccccc3cc12
Show InChI InChI=1S/C18H14N8/c1-2-4-12-10-14-13(9-11(12)3-1)17(21-15-5-7-19-23-15)25-26-18(14)22-16-6-8-20-24-16/h1-10H,(H2,19,21,23,25)(H2,20,22,24,26)
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n/an/a 9.66E+4n/an/an/an/an/an/a



Universidad de Granada

Curated by ChEMBL


Assay Description
Inhibition of human Cu-Zn superoxide dismutase assessed as inhibition of NADPH reduction


J Med Chem 54: 970-9 (2011)


Article DOI: 10.1021/jm101198k
BindingDB Entry DOI: 10.7270/Q24M94TW
More data for this
Ligand-Target Pair
Superoxide dismutase [Cu-Zn]


(Homo sapiens (Human))
BDBM50336563
PNG
(4-Chloro-1-(3'-pyrazolylamino)benzo[g]phthalazine ...)
Show SMILES Clc1nnc(Nc2ccn[nH]2)c2cc3ccccc3cc12
Show InChI InChI=1S/C15H10ClN5/c16-14-11-7-9-3-1-2-4-10(9)8-12(11)15(21-20-14)18-13-5-6-17-19-13/h1-8H,(H2,17,18,19,21)
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n/an/a 1.03E+5n/an/an/an/an/an/a



Universidad de Granada

Curated by ChEMBL


Assay Description
Inhibition of human Cu-Zn superoxide dismutase assessed as inhibition of NADPH reduction


J Med Chem 54: 970-9 (2011)


Article DOI: 10.1021/jm101198k
BindingDB Entry DOI: 10.7270/Q24M94TW
More data for this
Ligand-Target Pair
Superoxide dismutase [Cu-Zn]


(Homo sapiens (Human))
BDBM50336561
PNG
(1-[3-(imidazol-1-yl)propylamino]-4-chlorobenzo[g]p...)
Show SMILES Clc1nnc(NCCCn2ccnc2)c2cc3ccccc3cc12
Show InChI InChI=1S/C18H16ClN5/c19-17-15-10-13-4-1-2-5-14(13)11-16(15)18(23-22-17)21-6-3-8-24-9-7-20-12-24/h1-2,4-5,7,9-12H,3,6,8H2,(H,21,23)
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n/an/a 1.29E+5n/an/an/an/an/an/a



Universidad de Granada

Curated by ChEMBL


Assay Description
Inhibition of human Cu-Zn superoxide dismutase assessed as inhibition of NADPH reduction


J Med Chem 54: 970-9 (2011)


Article DOI: 10.1021/jm101198k
BindingDB Entry DOI: 10.7270/Q24M94TW
More data for this
Ligand-Target Pair
Superoxide dismutase [Cu-Zn]


(Homo sapiens (Human))
BDBM50336558
PNG
(1,4-bis[2-(imidazol-4-yl)ethylamino]benzo[g]phthal...)
Show SMILES C(Cc1cnc[nH]1)Nc1nnc(NCCc2cnc[nH]2)c2cc3ccccc3cc12
Show InChI InChI=1S/C22H22N8/c1-2-4-16-10-20-19(9-15(16)3-1)21(25-7-5-17-11-23-13-27-17)29-30-22(20)26-8-6-18-12-24-14-28-18/h1-4,9-14H,5-8H2,(H,23,27)(H,24,28)(H,25,29)(H,26,30)
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n/an/a 3.66E+5n/an/an/an/an/an/a



Universidad de Granada

Curated by ChEMBL


Assay Description
Inhibition of human Cu-Zn superoxide dismutase assessed as inhibition of NADPH reduction


J Med Chem 54: 970-9 (2011)


Article DOI: 10.1021/jm101198k
BindingDB Entry DOI: 10.7270/Q24M94TW
More data for this
Ligand-Target Pair
Superoxide dismutase [Cu-Zn]


(Homo sapiens (Human))
BDBM50336559
PNG
(1-[2-(imidazol-4-yl)ethylamino]-4-chlorobenzo[g]ph...)
Show SMILES Clc1nnc(NCCc2cnc[nH]2)c2cc3ccccc3cc12
Show InChI InChI=1S/C17H14ClN5/c18-16-14-7-11-3-1-2-4-12(11)8-15(14)17(23-22-16)20-6-5-13-9-19-10-21-13/h1-4,7-10H,5-6H2,(H,19,21)(H,20,23)
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n/an/a 7.87E+5n/an/an/an/an/an/a



Universidad de Granada

Curated by ChEMBL


Assay Description
Inhibition of human Cu-Zn superoxide dismutase assessed as inhibition of NADPH reduction


J Med Chem 54: 970-9 (2011)


Article DOI: 10.1021/jm101198k
BindingDB Entry DOI: 10.7270/Q24M94TW
More data for this
Ligand-Target Pair