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Compile Data Set for Download or QSAR

Found 8 hits with Last Name = 'rivero-cruz' 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
Oligo-1,6-glucosidase IMA1


(Saccharomyces cerevisiae S288c (Baker's yeast))
BDBM50341204
PNG
((Z)-3-butylidenephthalide | CHEMBL1765390)
Show SMILES CCC\C=C1\OC(=O)c2ccccc12
Show InChI InChI=1S/C12H12O2/c1-2-3-8-11-9-6-4-5-7-10(9)12(13)14-11/h4-8H,2-3H2,1H3/b11-8+
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4.86E+3n/an/an/an/an/an/an/an/a



Universidad Nacional Aut£noma de M£xico

Curated by ChEMBL


Assay Description
Mixed type inhibition of baker's yeast alpha-glucosidase by Dixon plot analysis


J Nat Prod 76: 468-83 (2013)


Article DOI: 10.1021/np300869g
BindingDB Entry DOI: 10.7270/Q28P61WB
More data for this
Ligand-Target Pair
Oligo-1,6-glucosidase IMA1


(Saccharomyces cerevisiae S288c (Baker's yeast))
BDBM50430024
PNG
(CHEMBL486219)
Show SMILES COc1cc(O)c2c(cc(=O)oc2c1)-c1ccc(O)c(O)c1
Show InChI InChI=1S/C16H12O6/c1-21-9-5-13(19)16-10(7-15(20)22-14(16)6-9)8-2-3-11(17)12(18)4-8/h2-7,17-19H,1H3
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n/an/a 6.20E+4n/an/an/an/an/an/a



Universidad Nacional Aut£noma de M£xico

Curated by ChEMBL


Assay Description
Inhibition of baker's yeast alpha-glucosidase


J Nat Prod 76: 468-83 (2013)


Article DOI: 10.1021/np300869g
BindingDB Entry DOI: 10.7270/Q28P61WB
More data for this
Ligand-Target Pair
Oligo-1,6-glucosidase IMA1


(Saccharomyces cerevisiae S288c (Baker's yeast))
BDBM23409
PNG
(3,5,7-trihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4H-...)
Show SMILES COc1cc(ccc1O)-c1oc2cc(O)cc(O)c2c(=O)c1O
Show InChI InChI=1S/C16H12O7/c1-22-11-4-7(2-3-9(11)18)16-15(21)14(20)13-10(19)5-8(17)6-12(13)23-16/h2-6,17-19,21H,1H3
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n/an/a 1.60E+5n/an/an/an/an/an/a



Universidad Nacional Aut£noma de M£xico

Curated by ChEMBL


Assay Description
Inhibition of baker's yeast alpha-glucosidase


J Nat Prod 76: 468-83 (2013)


Article DOI: 10.1021/np300869g
BindingDB Entry DOI: 10.7270/Q28P61WB
More data for this
Ligand-Target Pair
Oligo-1,6-glucosidase IMA1


(Saccharomyces cerevisiae S288c (Baker's yeast))
BDBM50430023
PNG
(CHEMBL2335914)
Show SMILES Oc1cc(O)c2c(cc(=O)oc2c1)-c1ccc(O)c(O)c1
Show InChI InChI=1S/C15H10O6/c16-8-4-12(19)15-9(6-14(20)21-13(15)5-8)7-1-2-10(17)11(18)3-7/h1-6,16-19H
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n/an/a 2.08E+5n/an/an/an/an/an/a



Universidad Nacional Aut£noma de M£xico

Curated by ChEMBL


Assay Description
Inhibition of baker's yeast alpha-glucosidase


J Nat Prod 76: 468-83 (2013)


Article DOI: 10.1021/np300869g
BindingDB Entry DOI: 10.7270/Q28P61WB
More data for this
Ligand-Target Pair
Oligo-1,6-glucosidase IMA1


(Saccharomyces cerevisiae S288c (Baker's yeast))
BDBM50430025
PNG
(CALEIN C)
Show SMILES C\C=C(/C)C(=O)O[C@H]1[C@@H]2[C@@H](C[C@@H](C)\C=C/C(=O)[C@](C)(O)[C@@H]1OC(C)=O)OC(=O)C2=C |r,c:13|
Show InChI InChI=1S/C22H28O8/c1-7-12(3)20(25)30-18-17-13(4)21(26)29-15(17)10-11(2)8-9-16(24)22(6,27)19(18)28-14(5)23/h7-9,11,15,17-19,27H,4,10H2,1-3,5-6H3/b9-8-,12-7+/t11-,15+,17-,18-,19+,22-/m0/s1
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n/an/a 2.80E+5n/an/an/an/an/an/a



Universidad Nacional Aut£noma de M£xico

Curated by ChEMBL


Assay Description
Inhibition of baker's yeast alpha-glucosidase


J Nat Prod 76: 468-83 (2013)


Article DOI: 10.1021/np300869g
BindingDB Entry DOI: 10.7270/Q28P61WB
More data for this
Ligand-Target Pair
Oligo-1,6-glucosidase IMA1


(Saccharomyces cerevisiae S288c (Baker's yeast))
BDBM50430026
PNG
(CHEMBL2047549)
Show SMILES CC1(C)Oc2ccc(C(=O)CO)c(O)c2C=C1 |c:16|
Show InChI InChI=1S/C13H14O4/c1-13(2)6-5-9-11(17-13)4-3-8(12(9)16)10(15)7-14/h3-6,14,16H,7H2,1-2H3
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n/an/a 4.20E+5n/an/an/an/an/an/a



Universidad Nacional Aut£noma de M£xico

Curated by ChEMBL


Assay Description
Inhibition of baker's yeast alpha-glucosidase


J Nat Prod 76: 468-83 (2013)


Article DOI: 10.1021/np300869g
BindingDB Entry DOI: 10.7270/Q28P61WB
More data for this
Ligand-Target Pair
Oligo-1,6-glucosidase IMA1


(Saccharomyces cerevisiae S288c (Baker's yeast))
BDBM7460
PNG
(2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4H-chrome...)
Show SMILES Oc1cc(O)c2c(c1)oc(-c1ccc(O)c(O)c1)c(O)c2=O
Show InChI InChI=1S/C15H10O7/c16-7-4-10(19)12-11(5-7)22-15(14(21)13(12)20)6-1-2-8(17)9(18)3-6/h1-5,16-19,21H
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n/an/a 5.30E+5n/an/an/an/an/an/a



Universidad Nacional Aut£noma de M£xico

Curated by ChEMBL


Assay Description
Inhibition of baker's yeast alpha-glucosidase


J Nat Prod 76: 468-83 (2013)


Article DOI: 10.1021/np300869g
BindingDB Entry DOI: 10.7270/Q28P61WB
More data for this
Ligand-Target Pair
Oligo-1,6-glucosidase IMA1


(Saccharomyces cerevisiae S288c (Baker's yeast))
BDBM50341204
PNG
((Z)-3-butylidenephthalide | CHEMBL1765390)
Show SMILES CCC\C=C1\OC(=O)c2ccccc12
Show InChI InChI=1S/C12H12O2/c1-2-3-8-11-9-6-4-5-7-10(9)12(13)14-11/h4-8H,2-3H2,1H3/b11-8+
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n/an/a 2.35E+6n/an/an/an/an/an/a



Universidad Nacional Aut£noma de M£xico

Curated by ChEMBL


Assay Description
Inhibition of baker's yeast alpha-glucosidase


J Nat Prod 76: 468-83 (2013)


Article DOI: 10.1021/np300869g
BindingDB Entry DOI: 10.7270/Q28P61WB
More data for this
Ligand-Target Pair