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16 similar compounds to monomer 36025

Compile data set for download or QSAR
Wt: 1211.0
BDBM36267
Wt: 272.2
BDBM50130191
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Wt: 286.2
BDBM50177403
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Wt: 284.2
BDBM50177404
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Wt: 272.2
BDBM50219502
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Wt: 284.2
BDBM50245886
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Wt: 242.2
BDBM50401863
Wt: 256.2
BDBM50401864
Wt: 256.2
BDBM50401865
Wt: 240.2
BDBM50401866
Wt: 276.2
BDBM50401869
Wt: 276.2
BDBM50401870
Wt: 276.2
BDBM50401871
Wt: 276.2
BDBM50401872
Wt: 466.4
BDBM50448392
Displayed 1 to 15 (of 16 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 37 hits for monomerid = 36267,50130191,50177403,50177404,50219502,50245886,50401863,50401864,50401865,50401866,50401869,50401870,50401871,50401872,50448392   
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
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50245886
PNG
(4-((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymet...)
Show SMILES OC[C@H]1O[C@@H](Oc2ccc(C=O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C13H16O7/c14-5-7-1-3-8(4-2-7)19-13-12(18)11(17)10(16)9(6-15)20-13/h1-5,9-13,15-18H,6H2/t9-,10-,11+,12-,13-/m1/s1
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730n/an/an/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of Electrophorus electricus AChE by Ellman's method


Eur J Med Chem 43: 166-73 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.018
BindingDB Entry DOI: 10.7270/Q2DF6S3Z
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50401872
PNG
(CHEMBL2205380)
Show SMILES OC[C@H]1O[C@@H](Oc2cccc3ccccc23)[C@H](O)[C@@H]1O
Show InChI InChI=1S/C15H16O5/c16-8-12-13(17)14(18)15(20-12)19-11-7-3-5-9-4-1-2-6-10(9)11/h1-7,12-18H,8H2/t12-,13-,14-,15-/m1/s1
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n/an/a 1.37E+6n/an/an/an/an/an/a



University of Delhi

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged c-Src preincubated for 30 mins measured after 60 mins


Bioorg Med Chem 20: 6821-30 (2012)


Article DOI: 10.1016/j.bmc.2012.09.057
BindingDB Entry DOI: 10.7270/Q23B619Q
More data for this
Ligand-Target Pair
Tyrosinase


(Agaricus bisporus (White button mushroom))
BDBM50219502
PNG
(4-hydroxyphenyl beta-D-glucopyranoside | Arbutin |...)
Show SMILES OC[C@H]1O[C@@H](Oc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C12H16O7/c13-5-8-9(15)10(16)11(17)12(19-8)18-7-3-1-6(14)2-4-7/h1-4,8-17H,5H2/t8-,9-,10+,11-,12-/m1/s1
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n/an/a 3.20E+5n/an/an/an/a6.837



Jeju National University



Assay Description
Briefly, mushroom tyrosinase (1250 units/mL) and 2 mM L-tyrosine (0.07 mL) were added to a solution of phosphate buffer (0.1 M, pH 6.8, 0.09 mL) cont...


J Enzyme Inhib Med Chem 28: 685-9 (2013)


Article DOI: 10.3109/14756366.2012.670806
BindingDB Entry DOI: 10.7270/Q2XS5T9S
More data for this
Ligand-Target Pair
Tyrosinase


(Agaricus bisporus (Common mushroom))
BDBM50219502
PNG
(4-hydroxyphenyl beta-D-glucopyranoside | Arbutin |...)
Show SMILES OC[C@H]1O[C@@H](Oc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C12H16O7/c13-5-8-9(15)10(16)11(17)12(19-8)18-7-3-1-6(14)2-4-7/h1-4,8-17H,5H2/t8-,9-,10+,11-,12-/m1/s1
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n/an/a 2.40E+7n/an/an/an/an/an/a



National Cheng Kung University

Curated by ChEMBL


Assay Description
Inhibition of mushroom tyrosinase


J Nat Prod 65: 1452-6 (2002)


Article DOI: 10.1021/np020188v
BindingDB Entry DOI: 10.7270/Q2PC324C
More data for this
Ligand-Target Pair
Tyrosinase


(Agaricus bisporus (Common mushroom))
BDBM50219502
PNG
(4-hydroxyphenyl beta-D-glucopyranoside | Arbutin |...)
Show SMILES OC[C@H]1O[C@@H](Oc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C12H16O7/c13-5-8-9(15)10(16)11(17)12(19-8)18-7-3-1-6(14)2-4-7/h1-4,8-17H,5H2/t8-,9-,10+,11-,12-/m1/s1
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n/an/a 2.40E+7n/an/an/an/an/an/a



National Cheng Kung University

Curated by ChEMBL


Assay Description
Inhibition of mushroom tyrosinase by spectrophotometry


J Nat Prod 67: 437-40 (2004)


Article DOI: 10.1021/np0302854
BindingDB Entry DOI: 10.7270/Q2TX3F4P
More data for this
Ligand-Target Pair
Gamma-amino-N-butyrate transaminase


(Homo sapiens (Human))
BDBM50177403
PNG
((2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-(4-(hydroxyme...)
Show SMILES OC[C@H]1O[C@@H](Oc2ccc(CO)cc2)[C@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C13H18O7/c14-5-7-1-3-8(4-2-7)19-13-12(18)11(17)10(16)9(6-15)20-13/h1-4,9-18H,5-6H2/t9-,10-,11+,12-,13-/m1/s1
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n/an/a>1.00E+6n/an/an/an/an/an/a



Huazhong University of Science and Technology

Curated by ChEMBL


Assay Description
Inhibitory activity against GABAT


Bioorg Med Chem Lett 16: 592-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.10.040
BindingDB Entry DOI: 10.7270/Q29G5MCH
More data for this
Ligand-Target Pair
Succinate semialdehyde dehydrogenase


(Homo sapiens (Human))
BDBM50177404
PNG
(4-((2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymet...)
Show SMILES OC[C@H]1O[C@@H](Oc2ccc(C=O)cc2)[C@H](O)[C@H](O)[C@@H]1O
Show InChI InChI=1S/C13H16O7/c14-5-7-1-3-8(4-2-7)19-13-12(18)11(17)10(16)9(6-15)20-13/h1-5,9-13,15-18H,6H2/t9-,10-,11-,12-,13-/m1/s1
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n/an/a>1.00E+6n/an/an/an/an/an/a



Huazhong University of Science and Technology

Curated by ChEMBL


Assay Description
Inhibitory activity against SSADH


Bioorg Med Chem Lett 16: 592-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.10.040
BindingDB Entry DOI: 10.7270/Q29G5MCH
More data for this
Ligand-Target Pair
Succinate semialdehyde dehydrogenase


(Homo sapiens (Human))
BDBM50177403
PNG
((2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-(4-(hydroxyme...)
Show SMILES OC[C@H]1O[C@@H](Oc2ccc(CO)cc2)[C@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C13H18O7/c14-5-7-1-3-8(4-2-7)19-13-12(18)11(17)10(16)9(6-15)20-13/h1-4,9-18H,5-6H2/t9-,10-,11+,12-,13-/m1/s1
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n/an/a>1.00E+6n/an/an/an/an/an/a



Huazhong University of Science and Technology

Curated by ChEMBL


Assay Description
Inhibitory activity against SSADH


Bioorg Med Chem Lett 16: 592-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.10.040
BindingDB Entry DOI: 10.7270/Q29G5MCH
More data for this
Ligand-Target Pair
Gamma-amino-N-butyrate transaminase


(Homo sapiens (Human))
BDBM50177404
PNG
(4-((2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymet...)
Show SMILES OC[C@H]1O[C@@H](Oc2ccc(C=O)cc2)[C@H](O)[C@H](O)[C@@H]1O
Show InChI InChI=1S/C13H16O7/c14-5-7-1-3-8(4-2-7)19-13-12(18)11(17)10(16)9(6-15)20-13/h1-5,9-13,15-18H,6H2/t9-,10-,11-,12-,13-/m1/s1
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n/an/a>1.00E+6n/an/an/an/an/an/a



Huazhong University of Science and Technology

Curated by ChEMBL


Assay Description
Inhibitory activity against GABAT


Bioorg Med Chem Lett 16: 592-5 (2005)


Article DOI: 10.1016/j.bmcl.2005.10.040
BindingDB Entry DOI: 10.7270/Q29G5MCH
More data for this
Ligand-Target Pair
Tyrosinase


(Homo sapiens (Human))
BDBM50219502
PNG
(4-hydroxyphenyl beta-D-glucopyranoside | Arbutin |...)
Show SMILES OC[C@H]1O[C@@H](Oc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C12H16O7/c13-5-8-9(15)10(16)11(17)12(19-8)18-7-3-1-6(14)2-4-7/h1-4,8-17H,5H2/t8-,9-,10+,11-,12-/m1/s1
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n/an/a 2.30E+5n/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of tyrosinase (unknown origin)


J Nat Prod 69: 1022-4 (2006)


Article DOI: 10.1021/np0600853
BindingDB Entry DOI: 10.7270/Q21C1WPT
More data for this
Ligand-Target Pair
Tyrosinase


(Homo sapiens (Human))
BDBM50219502
PNG
(4-hydroxyphenyl beta-D-glucopyranoside | Arbutin |...)
Show SMILES OC[C@H]1O[C@@H](Oc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C12H16O7/c13-5-8-9(15)10(16)11(17)12(19-8)18-7-3-1-6(14)2-4-7/h1-4,8-17H,5H2/t8-,9-,10+,11-,12-/m1/s1
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n/an/a 3.03E+4n/an/an/an/an/an/a



AmorePacific Corporation

Curated by ChEMBL


Assay Description
Inhibition of tyrosinase in Melan-a cells


Bioorg Med Chem Lett 17: 5462-4 (2007)


Article DOI: 10.1016/j.bmcl.2007.07.032
BindingDB Entry DOI: 10.7270/Q2BZ65RK
More data for this
Ligand-Target Pair
Tyrosinase


(Agaricus bisporus (Common mushroom))
BDBM50219502
PNG
(4-hydroxyphenyl beta-D-glucopyranoside | Arbutin |...)
Show SMILES OC[C@H]1O[C@@H](Oc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C12H16O7/c13-5-8-9(15)10(16)11(17)12(19-8)18-7-3-1-6(14)2-4-7/h1-4,8-17H,5H2/t8-,9-,10+,11-,12-/m1/s1
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n/an/a 1.04E+7n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of mushroom tyrosinase


Eur J Med Chem 44: 1773-8 (2009)


Article DOI: 10.1016/j.ejmech.2008.04.002
BindingDB Entry DOI: 10.7270/Q2DB81M9
More data for this
Ligand-Target Pair
Tyrosinase


(Agaricus bisporus (Common mushroom))
BDBM50177404
PNG
(4-((2S,3R,4R,5S,6R)-3,4,5-trihydroxy-6-(hydroxymet...)
Show SMILES OC[C@H]1O[C@@H](Oc2ccc(C=O)cc2)[C@H](O)[C@H](O)[C@@H]1O
Show InChI InChI=1S/C13H16O7/c14-5-7-1-3-8(4-2-7)19-13-12(18)11(17)10(16)9(6-15)20-13/h1-5,9-13,15-18H,6H2/t9-,10-,11-,12-,13-/m1/s1
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n/an/a 2.54E+6n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of mushroom tyrosinase assessed as 3,4-dihydroxy-L-phenylalanine oxidation


Bioorg Med Chem Lett 18: 6490-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.10.056
BindingDB Entry DOI: 10.7270/Q2959HFK
More data for this
Ligand-Target Pair
Tyrosinase


(Agaricus bisporus (Common mushroom))
BDBM50245886
PNG
(4-((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymet...)
Show SMILES OC[C@H]1O[C@@H](Oc2ccc(C=O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C13H16O7/c14-5-7-1-3-8(4-2-7)19-13-12(18)11(17)10(16)9(6-15)20-13/h1-5,9-13,15-18H,6H2/t9-,10-,11+,12-,13-/m1/s1
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n/an/a 9.40E+5n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of mushroom tyrosinase assessed as 3,4-dihydroxy-L-phenylalanine oxidation


Bioorg Med Chem Lett 18: 6490-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.10.056
BindingDB Entry DOI: 10.7270/Q2959HFK
More data for this
Ligand-Target Pair
Tyrosinase


(Agaricus bisporus (Common mushroom))
BDBM50219502
PNG
(4-hydroxyphenyl beta-D-glucopyranoside | Arbutin |...)
Show SMILES OC[C@H]1O[C@@H](Oc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C12H16O7/c13-5-8-9(15)10(16)11(17)12(19-8)18-7-3-1-6(14)2-4-7/h1-4,8-17H,5H2/t8-,9-,10+,11-,12-/m1/s1
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n/an/a 7.30E+6n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of mushroom tyrosinase assessed as 3,4-dihydroxy-L-phenylalanine oxidation


Bioorg Med Chem Lett 18: 6490-3 (2008)


Article DOI: 10.1016/j.bmcl.2008.10.056
BindingDB Entry DOI: 10.7270/Q2959HFK
More data for this
Ligand-Target Pair
Tyrosinase


(Agaricus bisporus (Common mushroom))
BDBM50219502
PNG
(4-hydroxyphenyl beta-D-glucopyranoside | Arbutin |...)
Show SMILES OC[C@H]1O[C@@H](Oc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C12H16O7/c13-5-8-9(15)10(16)11(17)12(19-8)18-7-3-1-6(14)2-4-7/h1-4,8-17H,5H2/t8-,9-,10+,11-,12-/m1/s1
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n/an/a 1.00E+5n/an/an/an/an/an/a



University of Rhode Island

Curated by ChEMBL


Assay Description
Inhibition of mushroom tyrosinase using L-tyrosine as a substrate after 30 mins by spectrophotometric method


J Nat Prod 79: 447-50 (2016)


Article DOI: 10.1021/acs.jnatprod.5b00972
BindingDB Entry DOI: 10.7270/Q2G73GNT
More data for this
Ligand-Target Pair
Tyrosinase


(Agaricus bisporus (Common mushroom))
BDBM50219502
PNG
(4-hydroxyphenyl beta-D-glucopyranoside | Arbutin |...)
Show SMILES OC[C@H]1O[C@@H](Oc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C12H16O7/c13-5-8-9(15)10(16)11(17)12(19-8)18-7-3-1-6(14)2-4-7/h1-4,8-17H,5H2/t8-,9-,10+,11-,12-/m1/s1
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n/an/a 7.30E+6n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of mushroom tyrosinase


Bioorg Med Chem Lett 19: 6157-60 (2009)


Article DOI: 10.1016/j.bmcl.2009.09.018
BindingDB Entry DOI: 10.7270/Q26973N0
More data for this
Ligand-Target Pair
Tyrosinase


(Agaricus bisporus (Common mushroom))
BDBM50219502
PNG
(4-hydroxyphenyl beta-D-glucopyranoside | Arbutin |...)
Show SMILES OC[C@H]1O[C@@H](Oc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C12H16O7/c13-5-8-9(15)10(16)11(17)12(19-8)18-7-3-1-6(14)2-4-7/h1-4,8-17H,5H2/t8-,9-,10+,11-,12-/m1/s1
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n/an/a>1.00E+6n/an/an/an/an/an/a



Kyoto Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of mushroom tyrosinase


Bioorg Med Chem 17: 6048-53 (2009)


Article DOI: 10.1016/j.bmc.2009.06.057
BindingDB Entry DOI: 10.7270/Q20G3K7R
More data for this
Ligand-Target Pair
Tyrosinase


(Mus musculus (Mouse))
BDBM50219502
PNG
(4-hydroxyphenyl beta-D-glucopyranoside | Arbutin |...)
Show SMILES OC[C@H]1O[C@@H](Oc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C12H16O7/c13-5-8-9(15)10(16)11(17)12(19-8)18-7-3-1-6(14)2-4-7/h1-4,8-17H,5H2/t8-,9-,10+,11-,12-/m1/s1
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n/an/a 3.03E+4n/an/an/an/an/an/a



AmorePacific Corporation

Curated by ChEMBL


Assay Description
Inhibition of tyrosinase in mouse Melan-a cells by ELISA


Bioorg Med Chem Lett 20: 1162-4 (2010)


Article DOI: 10.1016/j.bmcl.2009.12.021
BindingDB Entry DOI: 10.7270/Q2M045JZ
More data for this
Ligand-Target Pair
Tyrosinase


(Agaricus bisporus (Common mushroom))
BDBM50219502
PNG
(4-hydroxyphenyl beta-D-glucopyranoside | Arbutin |...)
Show SMILES OC[C@H]1O[C@@H](Oc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C12H16O7/c13-5-8-9(15)10(16)11(17)12(19-8)18-7-3-1-6(14)2-4-7/h1-4,8-17H,5H2/t8-,9-,10+,11-,12-/m1/s1
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n/an/a 2.10E+5n/an/an/an/an/an/a



Jinan University

Curated by ChEMBL


Assay Description
Inhibition of mushroom tyrosinase after 30 mins


Bioorg Med Chem 18: 6708-14 (2010)


Article DOI: 10.1016/j.bmc.2010.07.062
BindingDB Entry DOI: 10.7270/Q2JS9QN4
More data for this
Ligand-Target Pair
Tyrosinase


(Agaricus bisporus (Common mushroom))
BDBM50219502
PNG
(4-hydroxyphenyl beta-D-glucopyranoside | Arbutin |...)
Show SMILES OC[C@H]1O[C@@H](Oc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C12H16O7/c13-5-8-9(15)10(16)11(17)12(19-8)18-7-3-1-6(14)2-4-7/h1-4,8-17H,5H2/t8-,9-,10+,11-,12-/m1/s1
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n/an/a 2.01E+5n/an/an/an/an/an/a



Kinki University

Curated by ChEMBL


Assay Description
Inhibition of mushroom tyrosinase after 25 mins by spectrophotometry


Bioorg Med Chem Lett 21: 1983-6 (2011)


Article DOI: 10.1016/j.bmcl.2011.02.028
BindingDB Entry DOI: 10.7270/Q2T43TCF
More data for this
Ligand-Target Pair
Tyrosinase


(Agaricus bisporus (Common mushroom))
BDBM50219502
PNG
(4-hydroxyphenyl beta-D-glucopyranoside | Arbutin |...)
Show SMILES OC[C@H]1O[C@@H](Oc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C12H16O7/c13-5-8-9(15)10(16)11(17)12(19-8)18-7-3-1-6(14)2-4-7/h1-4,8-17H,5H2/t8-,9-,10+,11-,12-/m1/s1
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n/an/a 1.04E+7n/an/an/an/an/an/a



Shaoyang University

Curated by ChEMBL


Assay Description
Inhibition of diphenolase activity of mushroom tyrosinase preincubated with compound for 10 mins before addition of L-DOPA as substrate by spectropho...


Bioorg Med Chem Lett 21: 2376-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.02.076
BindingDB Entry DOI: 10.7270/Q2SF2WG1
More data for this
Ligand-Target Pair
Tyrosinase


(Mus musculus (Mouse))
BDBM50219502
PNG
(4-hydroxyphenyl beta-D-glucopyranoside | Arbutin |...)
Show SMILES OC[C@H]1O[C@@H](Oc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C12H16O7/c13-5-8-9(15)10(16)11(17)12(19-8)18-7-3-1-6(14)2-4-7/h1-4,8-17H,5H2/t8-,9-,10+,11-,12-/m1/s1
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n/an/a 1.55E+6n/an/an/an/an/an/a



Catholic University of Daegu

Curated by ChEMBL


Assay Description
Inhibition of tyrosinase activity in alpha-MSH-stimulated mouse B16 cells using L-tyrosine as substrate


Bioorg Med Chem 19: 2168-75 (2011)


Article DOI: 10.1016/j.bmc.2011.02.044
BindingDB Entry DOI: 10.7270/Q2K937TS
More data for this
Ligand-Target Pair
Tyrosinase


(Homo sapiens (Human))
BDBM50219502
PNG
(4-hydroxyphenyl beta-D-glucopyranoside | Arbutin |...)
Show SMILES OC[C@H]1O[C@@H](Oc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C12H16O7/c13-5-8-9(15)10(16)11(17)12(19-8)18-7-3-1-6(14)2-4-7/h1-4,8-17H,5H2/t8-,9-,10+,11-,12-/m1/s1
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n/an/a 3.20E+7n/an/an/an/an/an/a



University of California

Curated by ChEMBL


Assay Description
Inhibitory activity against mushroom tyrosinase


Bioorg Med Chem Lett 13: 2409-12 (2003)


Article DOI: 10.1016/s0960-894x(03)00395-0
BindingDB Entry DOI: 10.7270/Q2HD7W6H
More data for this
Ligand-Target Pair
CD209 antigen


(Homo sapiens (Human))
BDBM50448392
PNG
(CHEMBL3121709)
Show SMILES COc1ccc(OCC(COc2ccc(OC)cc2)O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)cc1
Show InChI InChI=1S/C23H30O10/c1-28-14-3-7-16(8-4-14)30-12-18(13-31-17-9-5-15(29-2)6-10-17)32-23-22(27)21(26)20(25)19(11-24)33-23/h3-10,18-27H,11-13H2,1-2H3/t19-,20-,21+,22+,23+/m1/s1
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n/an/a 5.15E+6n/an/an/an/an/an/a



University of Ljubljana

Curated by ChEMBL


Assay Description
Displacement of biotinylated HIV1 gp120 from DC-SIGN receptor carbohydrate recognition domain (unknown origin) after 2 hrs by solid-phase competitive...


Eur J Med Chem 75: 308-26 (2014)


Article DOI: 10.1016/j.ejmech.2014.01.047
BindingDB Entry DOI: 10.7270/Q29K4CQR
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50245886
PNG
(4-((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymet...)
Show SMILES OC[C@H]1O[C@@H](Oc2ccc(C=O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C13H16O7/c14-5-7-1-3-8(4-2-7)19-13-12(18)11(17)10(16)9(6-15)20-13/h1-5,9-13,15-18H,6H2/t9-,10-,11+,12-,13-/m1/s1
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n/an/a 450n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of Electrophorus electricus AChE by Ellman's method


Eur J Med Chem 43: 166-73 (2008)


Article DOI: 10.1016/j.ejmech.2007.03.018
BindingDB Entry DOI: 10.7270/Q2DF6S3Z
More data for this
Ligand-Target Pair
Tyrosinase


(Agaricus bisporus (Common mushroom))
BDBM50219502
PNG
(4-hydroxyphenyl beta-D-glucopyranoside | Arbutin |...)
Show SMILES OC[C@H]1O[C@@H](Oc2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C12H16O7/c13-5-8-9(15)10(16)11(17)12(19-8)18-7-3-1-6(14)2-4-7/h1-4,8-17H,5H2/t8-,9-,10+,11-,12-/m1/s1
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n/an/a 1.04E+7n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of mushroom tyrosinase


Bioorg Med Chem 16: 1096-102 (2008)


Article DOI: 10.1016/j.bmc.2007.10.102
BindingDB Entry DOI: 10.7270/Q2RF5VWT
More data for this
Ligand-Target Pair
Tyrosinase


(Agaricus bisporus (Common mushroom))
BDBM50245886
PNG
(4-((2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymet...)
Show SMILES OC[C@H]1O[C@@H](Oc2ccc(C=O)cc2)[C@H](O)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C13H16O7/c14-5-7-1-3-8(4-2-7)19-13-12(18)11(17)10(16)9(6-15)20-13/h1-5,9-13,15-18H,6H2/t9-,10-,11+,12-,13-/m1/s1
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n/an/a 9.40E+5n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of diphenolase activity of mushroom tyrosinase


Bioorg Med Chem Lett 19: 4055-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.018
BindingDB Entry DOI: 10.7270/Q29024RP
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50401863
PNG
(CHEMBL2205394)
Show SMILES OC[C@H]1O[C@@H](Oc2ccc(O)cc2)[C@H](O)[C@@H]1O
Show InChI InChI=1S/C11H14O6/c12-5-8-9(14)10(15)11(17-8)16-7-3-1-6(13)2-4-7/h1-4,8-15H,5H2/t8-,9-,10-,11-/m1/s1
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n/an/a 2.72E+5n/an/an/an/an/an/a



University of Delhi

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged c-Src preincubated for 30 mins measured after 60 mins


Bioorg Med Chem 20: 6821-30 (2012)


Article DOI: 10.1016/j.bmc.2012.09.057
BindingDB Entry DOI: 10.7270/Q23B619Q
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50401864
PNG
(CHEMBL2205392)
Show SMILES COc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1
Show InChI InChI=1S/C12H16O6/c1-16-7-2-4-8(5-3-7)17-12-11(15)10(14)9(6-13)18-12/h2-5,9-15H,6H2,1H3/t9-,10-,11-,12-/m1/s1
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n/an/a 4.84E+5n/an/an/an/an/an/a



University of Delhi

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged c-Src preincubated for 30 mins measured after 60 mins


Bioorg Med Chem 20: 6821-30 (2012)


Article DOI: 10.1016/j.bmc.2012.09.057
BindingDB Entry DOI: 10.7270/Q23B619Q
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50401865
PNG
(CHEMBL2205390)
Show SMILES COc1cccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1
Show InChI InChI=1S/C12H16O6/c1-16-7-3-2-4-8(5-7)17-12-11(15)10(14)9(6-13)18-12/h2-5,9-15H,6H2,1H3/t9-,10-,11-,12-/m1/s1
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n/an/a 9.50E+4n/an/an/an/an/an/a



University of Delhi

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged c-Src preincubated for 30 mins measured after 60 mins


Bioorg Med Chem 20: 6821-30 (2012)


Article DOI: 10.1016/j.bmc.2012.09.057
BindingDB Entry DOI: 10.7270/Q23B619Q
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50401866
PNG
(CHEMBL2205388)
Show SMILES Cc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1
Show InChI InChI=1S/C12H16O5/c1-7-2-4-8(5-3-7)16-12-11(15)10(14)9(6-13)17-12/h2-5,9-15H,6H2,1H3/t9-,10-,11-,12-/m1/s1
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n/an/a 1.43E+5n/an/an/an/an/an/a



University of Delhi

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged c-Src preincubated for 30 mins measured after 60 mins


Bioorg Med Chem 20: 6821-30 (2012)


Article DOI: 10.1016/j.bmc.2012.09.057
BindingDB Entry DOI: 10.7270/Q23B619Q
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50401869
PNG
(CHEMBL2205383)
Show SMILES OC[C@H]1O[C@H](Oc2ccc3ccccc3c2)[C@H](O)[C@@H]1O
Show InChI InChI=1S/C15H16O5/c16-8-12-13(17)14(18)15(20-12)19-11-6-5-9-3-1-2-4-10(9)7-11/h1-7,12-18H,8H2/t12-,13-,14-,15+/m1/s1
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n/an/a 2.97E+5n/an/an/an/an/an/a



University of Delhi

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged c-Src preincubated for 30 mins measured after 60 mins


Bioorg Med Chem 20: 6821-30 (2012)


Article DOI: 10.1016/j.bmc.2012.09.057
BindingDB Entry DOI: 10.7270/Q23B619Q
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50401870
PNG
(CHEMBL2205382)
Show SMILES OC[C@H]1O[C@@H](Oc2ccc3ccccc3c2)[C@H](O)[C@@H]1O
Show InChI InChI=1S/C15H16O5/c16-8-12-13(17)14(18)15(20-12)19-11-6-5-9-3-1-2-4-10(9)7-11/h1-7,12-18H,8H2/t12-,13-,14-,15-/m1/s1
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n/an/a 2.25E+5n/an/an/an/an/an/a



University of Delhi

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged c-Src preincubated for 30 mins measured after 60 mins


Bioorg Med Chem 20: 6821-30 (2012)


Article DOI: 10.1016/j.bmc.2012.09.057
BindingDB Entry DOI: 10.7270/Q23B619Q
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM50401871
PNG
(CHEMBL2205381)
Show SMILES OC[C@H]1O[C@H](Oc2cccc3ccccc23)[C@H](O)[C@@H]1O
Show InChI InChI=1S/C15H16O5/c16-8-12-13(17)14(18)15(20-12)19-11-7-3-5-9-4-1-2-6-10(9)11/h1-7,12-18H,8H2/t12-,13-,14-,15+/m1/s1
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n/an/a 1.85E+5n/an/an/an/an/an/a



University of Delhi

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged c-Src preincubated for 30 mins measured after 60 mins


Bioorg Med Chem 20: 6821-30 (2012)


Article DOI: 10.1016/j.bmc.2012.09.057
BindingDB Entry DOI: 10.7270/Q23B619Q
More data for this
Ligand-Target Pair
Tyrosinase


(Mus musculus (Mouse))
BDBM50130191
PNG
(2-Hydroxymethyl-6-(4-hydroxy-phenoxy)-tetrahydro-p...)
Show SMILES OCC1OC(Oc2ccc(O)cc2)C(O)C(O)C1O
Show InChI InChI=1S/C12H16O7/c13-5-8-9(15)10(16)11(17)12(19-8)18-7-3-1-6(14)2-4-7/h1-4,8-17H,5H2
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n/an/a 6.25E+5n/an/an/an/a6.825



National Tsing Hua University



Assay Description
The enzyme activity was monitored by dopachrome formation at 475nm for an appropriate period.


J Enzyme Inhib Med Chem 23: 526-34 (2008)


Article DOI: 10.1080/14756360701654894
BindingDB Entry DOI: 10.7270/Q29885MB
More data for this
Ligand-Target Pair
Tyrosinase


(Agaricus bisporus (Common mushroom))
BDBM50130191
PNG
(2-Hydroxymethyl-6-(4-hydroxy-phenoxy)-tetrahydro-p...)
Show SMILES OCC1OC(Oc2ccc(O)cc2)C(O)C(O)C1O
Show InChI InChI=1S/C12H16O7/c13-5-8-9(15)10(16)11(17)12(19-8)18-7-3-1-6(14)2-4-7/h1-4,8-17H,5H2
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n/an/a 2.96E+5n/an/an/an/a6.825



National Tsing Hua University



Assay Description
The enzyme activity was monitored by dopachrome formation at 475nm for an appropriate period.


J Enzyme Inhib Med Chem 23: 526-34 (2008)


Article DOI: 10.1080/14756360701654894
BindingDB Entry DOI: 10.7270/Q29885MB
More data for this
Ligand-Target Pair

Activity Spreadsheet -- ITC Data from BindingDB

Found 8 hits for monomerid = 36267,50130191,50177403,50177404,50219502,50245886,50401863,50401864,50401865,50401866,50401869,50401870,50401871,50401872,50448392
Cell (A)Syringe (B)Cell
Links
Syringe
Links
Cell + Syr
Links
ΔG°
kcal/mole
-TΔS°
kcal/mole
ΔH°
kcal/mole
log KpHTemp
°C
BDBM36267
JPEG
BDBM36176
JPEG
PC cid
PC sid
CHEBI
KEGG
MMDB
PC cid
PC sid
PDB
-3.53-3.17-0.3652.597.2025



Nankai University





J Org Chem 69: 173-80 (2004)

BDBM36267
JPEG
BDBM5
JPEG
PC cid
PC sid
CHEBI
DrugBank
KEGG
MMDB
PC cid
PC sid
PDB
-3.98-2.54-1.452.927.2025



Nankai University





J Org Chem 69: 173-80 (2004)

BDBM36267
JPEG
BDBM36178
JPEG
PC cid
PC sid
PC cid
PC sid
-4.84-2.35-2.483.557.2025



Nankai University





J Org Chem 69: 173-80 (2004)

BDBM36267
JPEG
BDBM36194
JPEG
PC cid
PC sid
PC cid
PC sid
-5.22-1.99-3.233.837.2025



Nankai University





J Org Chem 69: 173-80 (2004)

BDBM36267
JPEG
BDBM36263
JPEG
PC cid
PC sid
CHEBI
KEGG
MMDB
PC cid
PC sid
PDB
-5.64-2.62-3.024.147.2025



Nankai University





J Org Chem 69: 173-80 (2004)

BDBM36267
JPEG
BDBM36264
JPEG
PC cid
PC sid
CHEBI
DrugBank
KEGG
MMDB
PC cid
PC sid
-5.13-1.73-3.403.767.2025



Nankai University





J Org Chem 69: 173-80 (2004)

BDBM36267
JPEG
BDBM36265
JPEG
PC cid
PC sid
CHEBI
KEGG
PC cid
PC sid
-6.20-1.58-4.614.557.2025



Nankai University





J Org Chem 69: 173-80 (2004)

BDBM36267
JPEG
BDBM36266
JPEG
PC cid
PC sid
CHEBI
KEGG
PC cid
PC sid
-6.15-1.62-4.534.517.2025



Nankai University





J Org Chem 69: 173-80 (2004)