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Compile Data Set for Download or QSAR

Found 23 hits Enz. Inhib. hit(s) with Target = 'Hyaluronidase-1'   
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
Hyaluronidase-1


(Homo sapiens (Human))
BDBM81868
PNG
(N-Substituted indole-2- and 3-carboxamide derivati...)
Show SMILES Fc1ccc(CNC(=O)c2cn(Cc3ccc(F)cc3)c3ccccc23)cc1
Show InChI InChI=1S/C23H18F2N2O/c24-18-9-5-16(6-10-18)13-26-23(28)21-15-27(22-4-2-1-3-20(21)22)14-17-7-11-19(25)12-8-17/h1-12,15H,13-14H2,(H,26,28)
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n/an/a 2.57E+4n/an/an/an/a7.037



TBA



Assay Description
Stains-all assay were used to test inhibitors at pH of 7.


Chem Biol Drug Des 70: 547-51 (2007)


Article DOI: 10.1111/j.1747-0285.2007.00590.x
BindingDB Entry DOI: 10.7270/Q2FB51F7
More data for this
Ligand-Target Pair
Hyaluronidase-1


(Homo sapiens (Human))
BDBM81862
PNG
(N-Substituted indole-2- and 3-carboxamide derivati...)
Show SMILES Fc1ccc(CNC(=O)c2cc3ccccc3n2Cc2ccccc2)cc1
Show InChI InChI=1S/C23H19FN2O/c24-20-12-10-17(11-13-20)15-25-23(27)22-14-19-8-4-5-9-21(19)26(22)16-18-6-2-1-3-7-18/h1-14H,15-16H2,(H,25,27)
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n/an/a 2.72E+4n/an/an/an/a7.037



TBA



Assay Description
Stains-all assay were used to test inhibitors at pH of 7.


Chem Biol Drug Des 70: 547-51 (2007)


Article DOI: 10.1111/j.1747-0285.2007.00590.x
BindingDB Entry DOI: 10.7270/Q2FB51F7
More data for this
Ligand-Target Pair
Hyaluronidase-1


(Homo sapiens (Human))
BDBM81865
PNG
(N-Substituted indole-2- and 3-carboxamide derivati...)
Show SMILES Fc1ccc(CNC(=O)c2cc3ccccc3n2Cc2ccc(F)cc2)cc1
Show InChI InChI=1S/C23H18F2N2O/c24-19-9-5-16(6-10-19)14-26-23(28)22-13-18-3-1-2-4-21(18)27(22)15-17-7-11-20(25)12-8-17/h1-13H,14-15H2,(H,26,28)
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n/an/a 2.99E+4n/an/an/an/a7.037



TBA



Assay Description
Stains-all assay were used to test inhibitors at pH of 7.


Chem Biol Drug Des 70: 547-51 (2007)


Article DOI: 10.1111/j.1747-0285.2007.00590.x
BindingDB Entry DOI: 10.7270/Q2FB51F7
More data for this
Ligand-Target Pair
Hyaluronidase-1


(Homo sapiens (Human))
BDBM81866
PNG
(N-Substituted indole-2- and 3-carboxamide derivati...)
Show SMILES Fc1ccc(Cn2cc(C(=O)NCc3ccccc3)c3ccccc23)cc1
Show InChI InChI=1S/C23H19FN2O/c24-19-12-10-18(11-13-19)15-26-16-21(20-8-4-5-9-22(20)26)23(27)25-14-17-6-2-1-3-7-17/h1-13,16H,14-15H2,(H,25,27)
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n/an/a 3.30E+4n/an/an/an/a7.037



TBA



Assay Description
Stains-all assay were used to test inhibitors at pH of 7.


Chem Biol Drug Des 70: 547-51 (2007)


Article DOI: 10.1111/j.1747-0285.2007.00590.x
BindingDB Entry DOI: 10.7270/Q2FB51F7
More data for this
Ligand-Target Pair
Hyaluronidase-1


(Homo sapiens (Human))
BDBM81864
PNG
(N-Substituted indole-2- and 3-carboxamide derivati...)
Show SMILES Fc1ccc(Cn2c(cc3ccccc23)C(=O)NCc2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C23H18ClFN2O/c24-19-9-5-16(6-10-19)14-26-23(28)22-13-18-3-1-2-4-21(18)27(22)15-17-7-11-20(25)12-8-17/h1-13H,14-15H2,(H,26,28)
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n/an/a 3.30E+4n/an/an/an/a7.037



TBA



Assay Description
Stains-all assay were used to test inhibitors at pH of 7.


Chem Biol Drug Des 70: 547-51 (2007)


Article DOI: 10.1111/j.1747-0285.2007.00590.x
BindingDB Entry DOI: 10.7270/Q2FB51F7
More data for this
Ligand-Target Pair
Hyaluronidase-1


(Homo sapiens (Human))
BDBM81861
PNG
(N-Substituted indole-2- and 3-carboxamide derivati...)
Show SMILES Clc1ccc(CNC(=O)c2cc3ccccc3n2Cc2ccccc2)cc1
Show InChI InChI=1S/C23H19ClN2O/c24-20-12-10-17(11-13-20)15-25-23(27)22-14-19-8-4-5-9-21(19)26(22)16-18-6-2-1-3-7-18/h1-14H,15-16H2,(H,25,27)
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n/an/a 3.32E+4n/an/an/an/a7.037



TBA



Assay Description
Stains-all assay were used to test inhibitors at pH of 7.


Chem Biol Drug Des 70: 547-51 (2007)


Article DOI: 10.1111/j.1747-0285.2007.00590.x
BindingDB Entry DOI: 10.7270/Q2FB51F7
More data for this
Ligand-Target Pair
Hyaluronidase-1


(Homo sapiens (Human))
BDBM81867
PNG
(N-Substituted indole-2- and 3-carboxamide derivati...)
Show SMILES Fc1ccc(Cn2cc(C(=O)NCc3ccc(Cl)cc3)c3ccccc23)cc1
Show InChI InChI=1S/C23H18ClFN2O/c24-18-9-5-16(6-10-18)13-26-23(28)21-15-27(22-4-2-1-3-20(21)22)14-17-7-11-19(25)12-8-17/h1-12,15H,13-14H2,(H,26,28)
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n/an/a 3.37E+4n/an/an/an/a7.037



TBA



Assay Description
Stains-all assay were used to test inhibitors at pH of 7.


Chem Biol Drug Des 70: 547-51 (2007)


Article DOI: 10.1111/j.1747-0285.2007.00590.x
BindingDB Entry DOI: 10.7270/Q2FB51F7
More data for this
Ligand-Target Pair
Hyaluronidase-1


(Homo sapiens (Human))
BDBM81860
PNG
(N-Substituted indole-2- and 3-carboxamide derivati...)
Show SMILES O=C(NCc1ccccc1)c1cc2ccccc2n1Cc1ccccc1
Show InChI InChI=1S/C23H20N2O/c26-23(24-16-18-9-3-1-4-10-18)22-15-20-13-7-8-14-21(20)25(22)17-19-11-5-2-6-12-19/h1-15H,16-17H2,(H,24,26)
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n/an/a 4.03E+4n/an/an/an/a7.037



TBA



Assay Description
Stains-all assay were used to test inhibitors at pH of 7.


Chem Biol Drug Des 70: 547-51 (2007)


Article DOI: 10.1111/j.1747-0285.2007.00590.x
BindingDB Entry DOI: 10.7270/Q2FB51F7
More data for this
Ligand-Target Pair
Hyaluronidase-1


(Homo sapiens (Human))
BDBM81863
PNG
(N-Substituted indole-2- and 3-carboxamide derivati...)
Show SMILES Fc1ccc(Cn2c(cc3ccccc23)C(=O)NCc2ccccc2)cc1
Show InChI InChI=1S/C23H19FN2O/c24-20-12-10-18(11-13-20)16-26-21-9-5-4-8-19(21)14-22(26)23(27)25-15-17-6-2-1-3-7-17/h1-14H,15-16H2,(H,25,27)
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n/an/a 4.11E+4n/an/an/an/a7.037



TBA



Assay Description
Stains-all assay were used to test inhibitors at pH of 7.


Chem Biol Drug Des 70: 547-51 (2007)


Article DOI: 10.1111/j.1747-0285.2007.00590.x
BindingDB Entry DOI: 10.7270/Q2FB51F7
More data for this
Ligand-Target Pair
Hyaluronidase-1


(Homo sapiens (Human))
BDBM81868
PNG
(N-Substituted indole-2- and 3-carboxamide derivati...)
Show SMILES Fc1ccc(CNC(=O)c2cn(Cc3ccc(F)cc3)c3ccccc23)cc1
Show InChI InChI=1S/C23H18F2N2O/c24-18-9-5-16(6-10-18)13-26-23(28)21-15-27(22-4-2-1-3-20(21)22)14-17-7-11-19(25)12-8-17/h1-12,15H,13-14H2,(H,26,28)
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n/an/a 5.67E+4n/an/an/an/a3.537



TBA



Assay Description
Morgan-elson assay were used to test inhibitors at pH of 3.5.


Chem Biol Drug Des 70: 547-51 (2007)


Article DOI: 10.1111/j.1747-0285.2007.00590.x
BindingDB Entry DOI: 10.7270/Q2FB51F7
More data for this
Ligand-Target Pair
Hyaluronidase-1


(Homo sapiens (Human))
BDBM81866
PNG
(N-Substituted indole-2- and 3-carboxamide derivati...)
Show SMILES Fc1ccc(Cn2cc(C(=O)NCc3ccccc3)c3ccccc23)cc1
Show InChI InChI=1S/C23H19FN2O/c24-19-12-10-18(11-13-19)15-26-16-21(20-8-4-5-9-22(20)26)23(27)25-14-17-6-2-1-3-7-17/h1-13,16H,14-15H2,(H,25,27)
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n/an/a 6.16E+4n/an/an/an/a3.537



TBA



Assay Description
Morgan-elson assay were used to test inhibitors at pH of 3.5.


Chem Biol Drug Des 70: 547-51 (2007)


Article DOI: 10.1111/j.1747-0285.2007.00590.x
BindingDB Entry DOI: 10.7270/Q2FB51F7
More data for this
Ligand-Target Pair
Hyaluronidase-1


(Homo sapiens (Human))
BDBM81861
PNG
(N-Substituted indole-2- and 3-carboxamide derivati...)
Show SMILES Clc1ccc(CNC(=O)c2cc3ccccc3n2Cc2ccccc2)cc1
Show InChI InChI=1S/C23H19ClN2O/c24-20-12-10-17(11-13-20)15-25-23(27)22-14-19-8-4-5-9-21(19)26(22)16-18-6-2-1-3-7-18/h1-14H,15-16H2,(H,25,27)
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n/an/a 6.43E+4n/an/an/an/a3.537



TBA



Assay Description
Morgan-elson assay were used to test inhibitors at pH of 3.5.


Chem Biol Drug Des 70: 547-51 (2007)


Article DOI: 10.1111/j.1747-0285.2007.00590.x
BindingDB Entry DOI: 10.7270/Q2FB51F7
More data for this
Ligand-Target Pair
Hyaluronidase-1


(Homo sapiens (Human))
BDBM81867
PNG
(N-Substituted indole-2- and 3-carboxamide derivati...)
Show SMILES Fc1ccc(Cn2cc(C(=O)NCc3ccc(Cl)cc3)c3ccccc23)cc1
Show InChI InChI=1S/C23H18ClFN2O/c24-18-9-5-16(6-10-18)13-26-23(28)21-15-27(22-4-2-1-3-20(21)22)14-17-7-11-19(25)12-8-17/h1-12,15H,13-14H2,(H,26,28)
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n/an/a 7.29E+4n/an/an/an/a3.537



TBA



Assay Description
Morgan-elson assay were used to test inhibitors at pH of 3.5.


Chem Biol Drug Des 70: 547-51 (2007)


Article DOI: 10.1111/j.1747-0285.2007.00590.x
BindingDB Entry DOI: 10.7270/Q2FB51F7
More data for this
Ligand-Target Pair
Hyaluronidase-1


(Homo sapiens (Human))
BDBM81860
PNG
(N-Substituted indole-2- and 3-carboxamide derivati...)
Show SMILES O=C(NCc1ccccc1)c1cc2ccccc2n1Cc1ccccc1
Show InChI InChI=1S/C23H20N2O/c26-23(24-16-18-9-3-1-4-10-18)22-15-20-13-7-8-14-21(20)25(22)17-19-11-5-2-6-12-19/h1-15H,16-17H2,(H,24,26)
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n/an/a 7.82E+4n/an/an/an/a3.537



TBA



Assay Description
Morgan-elson assay were used to test inhibitors at pH of 3.5.


Chem Biol Drug Des 70: 547-51 (2007)


Article DOI: 10.1111/j.1747-0285.2007.00590.x
BindingDB Entry DOI: 10.7270/Q2FB51F7
More data for this
Ligand-Target Pair
Hyaluronidase-1


(Homo sapiens (Human))
BDBM50316415
PNG
(CHEMBL1097937 | Cimicifugic acid L | cimicifugic a...)
Show SMILES COc1ccc(\C=C\C(=O)O[C@H](C(O)=O)[C@](O)(Cc2ccc(O)cc2)C(O)=O)cc1OC |r|
Show InChI InChI=1S/C22H22O10/c1-30-16-9-5-13(11-17(16)31-2)6-10-18(24)32-19(20(25)26)22(29,21(27)28)12-14-3-7-15(23)8-4-14/h3-11,19,23,29H,12H2,1-2H3,(H,25,26)(H,27,28)/b10-6+/t19-,22-/m1/s1
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n/an/a 1.02E+5n/an/an/an/an/an/a



University of Shizuoka

Curated by ChEMBL


Assay Description
Inhibition of hyaluronidase


J Nat Prod 73: 609-12 (2010)


Article DOI: 10.1021/np900752t
BindingDB Entry DOI: 10.7270/Q2GF0TNW
More data for this
Ligand-Target Pair
Hyaluronidase-1


(Homo sapiens (Human))
BDBM50316417
PNG
(CHEMBL1094303 | Cimicifugic acid N)
Show SMILES COc1ccc(\C=C/C(=O)O[C@H](C(O)=O)[C@](O)(Cc2ccc(O)c(O)c2)C(O)=O)cc1OC |r|
Show InChI InChI=1S/C22H22O11/c1-31-16-7-4-12(10-17(16)32-2)5-8-18(25)33-19(20(26)27)22(30,21(28)29)11-13-3-6-14(23)15(24)9-13/h3-10,19,23-24,30H,11H2,1-2H3,(H,26,27)(H,28,29)/b8-5-/t19-,22-/m1/s1
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n/an/a 1.20E+5n/an/an/an/an/an/a



University of Shizuoka

Curated by ChEMBL


Assay Description
Inhibition of hyaluronidase


J Nat Prod 73: 609-12 (2010)


Article DOI: 10.1021/np900752t
BindingDB Entry DOI: 10.7270/Q2GF0TNW
More data for this
Ligand-Target Pair
Hyaluronidase-1


(Homo sapiens (Human))
BDBM50316416
PNG
(CHEMBL1096937 | Cimicifugic acid M)
Show SMILES OC(=O)[C@@H](OC(=O)\C=C\c1ccc(O)c(O)c1)[C@](O)(Cc1ccccc1)C(O)=O |r|
Show InChI InChI=1S/C20H18O9/c21-14-8-6-12(10-15(14)22)7-9-16(23)29-17(18(24)25)20(28,19(26)27)11-13-4-2-1-3-5-13/h1-10,17,21-22,28H,11H2,(H,24,25)(H,26,27)/b9-7+/t17-,20-/m1/s1
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n/an/a 1.73E+5n/an/an/an/an/an/a



University of Shizuoka

Curated by ChEMBL


Assay Description
Inhibition of hyaluronidase


J Nat Prod 73: 609-12 (2010)


Article DOI: 10.1021/np900752t
BindingDB Entry DOI: 10.7270/Q2GF0TNW
More data for this
Ligand-Target Pair
Hyaluronidase-1


(Homo sapiens (Human))
BDBM50316414
PNG
(CHEMBL1096631 | Cimicifugic acid K)
Show SMILES OC(=O)[C@@H](OC(=O)\C=C\c1ccc(O)cc1)[C@](O)(Cc1ccc(O)cc1)C(O)=O |r|
Show InChI InChI=1S/C20H18O9/c21-14-6-1-12(2-7-14)5-10-16(23)29-17(18(24)25)20(28,19(26)27)11-13-3-8-15(22)9-4-13/h1-10,17,21-22,28H,11H2,(H,24,25)(H,26,27)/b10-5+/t17-,20-/m1/s1
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n/an/a 2.55E+5n/an/an/an/an/an/a



University of Shizuoka

Curated by ChEMBL


Assay Description
Inhibition of hyaluronidase


J Nat Prod 73: 609-12 (2010)


Article DOI: 10.1021/np900752t
BindingDB Entry DOI: 10.7270/Q2GF0TNW
More data for this
Ligand-Target Pair
Hyaluronidase-1/Hyaluronidase-2


(Bos taurus )
BDBM50292241
PNG
(CHEMBL4159080)
Show SMILES Cl.Clc1cc(cnc1Cl)C(=O)NCCCNc1c2CCCCc2nc2ccccc12
Show InChI InChI=1S/C22H22Cl2N4O/c23-17-12-14(13-27-21(17)24)22(29)26-11-5-10-25-20-15-6-1-3-8-18(15)28-19-9-4-2-7-16(19)20/h1,3,6,8,12-13H,2,4-5,7,9-11H2,(H,25,28)(H,26,29)
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n/an/a 4.66E+5n/an/an/an/an/an/a



Medical University of Lodz

Curated by ChEMBL


Assay Description
Inhibition of bovine testes hyaluronidase using hyaluronic acid as substrate preincubated for 10 mins in dark followed by incubation with substrate f...


Eur J Med Chem 145: 760-769 (2018)


Article DOI: 10.1016/j.ejmech.2018.01.014
BindingDB Entry DOI: 10.7270/Q2WM1GZM
More data for this
Ligand-Target Pair
Hyaluronidase-1


(Homo sapiens (Human))
BDBM50133496
PNG
((2R)-3-(3,4-dihydroxyphenyl)-2-[(2E)-3-(3,4-dihydr...)
Show SMILES OC(=O)[C@@H](Cc1ccc(O)c(O)c1)OC(=O)\C=C\c1ccc(O)c(O)c1 |r|
Show InChI InChI=1S/C18H16O8/c19-12-4-1-10(7-14(12)21)3-6-17(23)26-16(18(24)25)9-11-2-5-13(20)15(22)8-11/h1-8,16,19-22H,9H2,(H,24,25)/b6-3+/t16-/m1/s1
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n/an/a 5.45E+5n/an/an/an/an/an/a



University of Shizuoka

Curated by ChEMBL


Assay Description
Inhibition of hyaluronidase


J Nat Prod 73: 609-12 (2010)


Article DOI: 10.1021/np900752t
BindingDB Entry DOI: 10.7270/Q2GF0TNW
More data for this
Ligand-Target Pair
Hyaluronidase-1


(Homo sapiens (Human))
BDBM4375
PNG
((2E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid | (2...)
Show SMILES OC(=O)\C=C\c1ccc(O)c(O)c1
Show InChI InChI=1S/C9H8O4/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5,10-11H,(H,12,13)/b4-2+
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n/an/a>2.00E+6n/an/an/an/an/an/a



University of Shizuoka

Curated by ChEMBL


Assay Description
Inhibition of hyaluronidase


J Nat Prod 73: 609-12 (2010)


Article DOI: 10.1021/np900752t
BindingDB Entry DOI: 10.7270/Q2GF0TNW
More data for this
Ligand-Target Pair
Hyaluronidase-1


(Homo sapiens (Human))
BDBM50214744
PNG
((2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic aci...)
Show SMILES COc1cc(\C=C\C(O)=O)ccc1O
Show InChI InChI=1S/C10H10O4/c1-14-9-6-7(2-4-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13)/b5-3+
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Article
PubMed
n/an/a>2.00E+6n/an/an/an/an/an/a



University of Shizuoka

Curated by ChEMBL


Assay Description
Inhibition of hyaluronidase


J Nat Prod 73: 609-12 (2010)


Article DOI: 10.1021/np900752t
BindingDB Entry DOI: 10.7270/Q2GF0TNW
More data for this
Ligand-Target Pair
Hyaluronidase-1


(Homo sapiens (Human))
BDBM50241245
PNG
((2E)-3-(3-hydroxy-4-methoxyphenyl)prop-2-enoic aci...)
Show SMILES COc1ccc(\C=C\C(O)=O)cc1O
Show InChI InChI=1S/C10H10O4/c1-14-9-4-2-7(6-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13)/b5-3+
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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CHEMBL
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UniChem

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Article
PubMed
n/an/a>2.00E+6n/an/an/an/an/an/a



University of Shizuoka

Curated by ChEMBL


Assay Description
Inhibition of hyaluronidase


J Nat Prod 73: 609-12 (2010)


Article DOI: 10.1021/np900752t
BindingDB Entry DOI: 10.7270/Q2GF0TNW
More data for this
Ligand-Target Pair