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Compile Data Set for Download or QSAR

Found 13 hits Enz. Inhib. hit(s) with Target = 'Beta-mannosidase' AND taxid = 10116   
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
Beta-mannosidase


(Rattus norvegicus)
BDBM50285807
PNG
(CHEMBL2368787)
Show SMILES OC[C@@H]1N=C(NCc2ccccc2)[C@@H](O)[C@@H](O)[C@@H]1O |r,t:3|
Show InChI InChI=1S/C13H18N2O4/c16-7-9-10(17)11(18)12(19)13(15-9)14-6-8-4-2-1-3-5-8/h1-5,9-12,16-19H,6-7H2,(H,14,15)/t9-,10+,11-,12-/m0/s1
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6.00E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition against Beta-mannosidase in snail


Bioorg Med Chem Lett 5: 2655-2660 (1995)


Article DOI: 10.1016/0960-894X(95)00474-8
BindingDB Entry DOI: 10.7270/Q21R6R0W
More data for this
Ligand-Target Pair
Beta-mannosidase


(Rattus norvegicus)
BDBM50285809
PNG
(CHEMBL2368788)
Show SMILES CO[C@H]1O[C@@H](CNC2=N[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)[C@@H](O)[C@H](O)[C@H]1O |r,t:7|
Show InChI InChI=1S/C13H24N2O9/c1-23-13-11(22)9(20)7(18)5(24-13)2-14-12-10(21)8(19)6(17)4(3-16)15-12/h4-11,13,16-22H,2-3H2,1H3,(H,14,15)/t4-,5-,6+,7+,8-,9-,10-,11+,13-/m0/s1
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1.00E+5n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition against Beta-mannosidase in snail


Bioorg Med Chem Lett 5: 2655-2660 (1995)


Article DOI: 10.1016/0960-894X(95)00474-8
BindingDB Entry DOI: 10.7270/Q21R6R0W
More data for this
Ligand-Target Pair
Beta-mannosidase


(Rattus norvegicus)
BDBM50242067
PNG
(CHEMBL469435 | alpha-1-C-(1,10,13-Trihydroxytridec...)
Show SMILES OCC(O)CCCCC(O)CC(O)CCC[C@@H](O)[C@H]1N[C@H](CO)[C@@H](O)[C@@H]1O |r|
Show InChI InChI=1S/C18H37NO8/c20-9-13(24)5-2-1-4-11(22)8-12(23)6-3-7-15(25)16-18(27)17(26)14(10-21)19-16/h11-27H,1-10H2/t11?,12?,13?,14-,15-,16-,17-,18-/m1/s1
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n/an/a 9.30E+3n/an/an/an/an/an/a



Hokuriku University

Curated by ChEMBL


Assay Description
Inhibition of rat epididymis beta-mannosidase by spectrophotometry


J Nat Prod 67: 846-50 (2004)


Article DOI: 10.1021/np0499721
BindingDB Entry DOI: 10.7270/Q2Q52PD8
More data for this
Ligand-Target Pair
Beta-mannosidase


(Rattus norvegicus)
BDBM50234567
PNG
(1,4-dideoxy-1,4-imino-D-ribitol | CHEMBL261634 | I...)
Show SMILES OC[C@H]1NC[C@H](O)[C@@H]1O |r|
Show InChI InChI=1S/C5H11NO3/c7-2-3-5(9)4(8)1-6-3/h3-9H,1-2H2/t3-,4+,5-/m1/s1
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n/an/a 1.80E+4n/an/an/an/an/an/a



Hokuriku University

Curated by ChEMBL


Assay Description
Inhibition of rat epididymis beta-mannosidase assessed as p-nitrophenol release by spectrophotometrically


J Nat Prod 65: 198-202 (2002)


BindingDB Entry DOI: 10.7270/Q2ZW1KN6
More data for this
Ligand-Target Pair
Beta-mannosidase


(Rattus norvegicus)
BDBM50279407
PNG
(2,5-Imino-2,5,7-trideoxy-D-glycero-D-manno-heptito...)
Show SMILES C[C@H](O)[C@H]1N[C@H](CO)[C@@H](O)[C@@H]1O |r|
Show InChI InChI=1S/C7H15NO4/c1-3(10)5-7(12)6(11)4(2-9)8-5/h3-12H,2H2,1H3/t3-,4+,5+,6+,7+/m0/s1
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n/an/a 3.50E+4n/an/an/an/an/an/a



Hokuriku University

Curated by ChEMBL


Assay Description
Inhibition of rat epididymis beta-mannosidase assessed as p-nitrophenol release after 30 mins by spectrophotometry


J Nat Prod 65: 1875-81 (2002)


Article DOI: 10.1021/np020296h
BindingDB Entry DOI: 10.7270/Q2NC60Z4
More data for this
Ligand-Target Pair
Beta-mannosidase


(Rattus norvegicus)
BDBM50279406
PNG
(2,5-Dideoxy-2,5-imino-glycero-D-manno-heptitol | C...)
Show SMILES OC[C@H](O)[C@H]1N[C@H](CO)[C@@H](O)[C@@H]1O |r|
Show InChI InChI=1S/C7H15NO5/c9-1-3-6(12)7(13)5(8-3)4(11)2-10/h3-13H,1-2H2/t3-,4+,5-,6-,7-/m1/s1
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n/an/a 5.30E+4n/an/an/an/an/an/a



Hokuriku University

Curated by ChEMBL


Assay Description
Inhibition of rat epididymis beta-mannosidase assessed as p-nitrophenol release after 30 mins by spectrophotometry


J Nat Prod 65: 1875-81 (2002)


Article DOI: 10.1021/np020296h
BindingDB Entry DOI: 10.7270/Q2NC60Z4
More data for this
Ligand-Target Pair
Beta-mannosidase


(Rattus norvegicus)
BDBM50242267
PNG
(2,5-imino-1,2,5-trideoxy-D-mannitol | CHEMBL443158)
Show SMILES C[C@H]1N[C@H](CO)[C@@H](O)[C@@H]1O |r|
Show InChI InChI=1S/C6H13NO3/c1-3-5(9)6(10)4(2-8)7-3/h3-10H,2H2,1H3/t3-,4-,5-,6-/m1/s1
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n/an/a 9.30E+4n/an/an/an/an/an/a



Hokuriku University

Curated by ChEMBL


Assay Description
Inhibition of rat epididymis beta-mannosidase assessed as p-nitrophenol release by spectrophotometrically


J Nat Prod 65: 198-202 (2002)


BindingDB Entry DOI: 10.7270/Q2ZW1KN6
More data for this
Ligand-Target Pair
Beta-mannosidase


(Rattus norvegicus)
BDBM50242066
PNG
(CHEMBL511823 | alpha-1-C-(1,2-Dihdroxypropyl)-1,4-...)
Show SMILES CC(O)[C@@H](O)[C@H]1N[C@H](CO)[C@@H](O)[C@@H]1O |r|
Show InChI InChI=1S/C8H17NO5/c1-3(11)6(12)5-8(14)7(13)4(2-10)9-5/h3-14H,2H2,1H3/t3?,4-,5-,6-,7-,8-/m1/s1
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n/an/a 1.50E+5n/an/an/an/an/an/a



Hokuriku University

Curated by ChEMBL


Assay Description
Inhibition of rat epididymis beta-mannosidase by spectrophotometry


J Nat Prod 67: 846-50 (2004)


Article DOI: 10.1021/np0499721
BindingDB Entry DOI: 10.7270/Q2Q52PD8
More data for this
Ligand-Target Pair
Beta-mannosidase


(Rattus norvegicus)
BDBM50279408
PNG
((2R,3S,4S,5S,6R)-2-((2R,3R,4R,5R)-4-hydroxy-2-(2-h...)
Show SMILES OCC[C@H]1N[C@H](CO)[C@@H](O)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O |r|
Show InChI InChI=1S/C13H25NO9/c15-2-1-5-12(8(18)6(3-16)14-5)23-13-11(21)10(20)9(19)7(4-17)22-13/h5-21H,1-4H2/t5-,6-,7-,8-,9-,10+,11+,12-,13+/m1/s1
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n/an/a 1.60E+5n/an/an/an/an/an/a



Hokuriku University

Curated by ChEMBL


Assay Description
Inhibition of rat epididymis beta-mannosidase assessed as p-nitrophenol release after 30 mins by spectrophotometry


J Nat Prod 65: 1875-81 (2002)


Article DOI: 10.1021/np020296h
BindingDB Entry DOI: 10.7270/Q2NC60Z4
More data for this
Ligand-Target Pair
Beta-mannosidase


(Rattus norvegicus)
BDBM50278882
PNG
((2S,3S,4S,5S,6R)-2-((2R,3S,4S,5R,6R)-3,5-dihydroxy...)
Show SMILES OCC[C@H]1N[C@H](CO)[C@@H](O)[C@@H]1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)[C@@H]1O |r|
Show InChI InChI=1S/C19H35NO14/c21-2-1-6-16(10(25)7(3-22)20-6)33-19-15(30)17(12(27)9(5-24)32-19)34-18-14(29)13(28)11(26)8(4-23)31-18/h6-30H,1-5H2/t6-,7-,8-,9-,10-,11-,12-,13+,14+,15+,16-,17+,18+,19+/m1/s1
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n/an/a 1.80E+5n/an/an/an/an/an/a



Hokuriku University

Curated by ChEMBL


Assay Description
Inhibition of rat epididymis beta-mannosidase assessed as p-nitrophenol release after 30 mins by spectrophotometry


J Nat Prod 65: 1875-81 (2002)


Article DOI: 10.1021/np020296h
BindingDB Entry DOI: 10.7270/Q2NC60Z4
More data for this
Ligand-Target Pair
Beta-mannosidase


(Rattus norvegicus)
BDBM50016703
PNG
(2-Hydroxymethyl-pyrrolidine-3,4-diol | BDBM5003148...)
Show SMILES OC[C@H]1NC[C@@H](O)[C@@H]1O |r|
Show InChI InChI=1S/C5H11NO3/c7-2-3-5(9)4(8)1-6-3/h3-9H,1-2H2/t3-,4-,5?/m1/s1
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n/an/a 2.90E+5n/an/an/an/an/an/a



Hokuriku University

Curated by ChEMBL


Assay Description
Inhibition of rat epididymis beta-mannosidase assessed as p-nitrophenol release by spectrophotometrically


J Nat Prod 65: 198-202 (2002)


BindingDB Entry DOI: 10.7270/Q2ZW1KN6
More data for this
Ligand-Target Pair
Beta-mannosidase


(Rattus norvegicus)
BDBM50234571
PNG
(2,5-imino-2,5,6-trideoxy-D-manno-heptitol | CHEMBL...)
Show SMILES OCC[C@H]1N[C@H](CO)[C@@H](O)[C@@H]1O |r|
Show InChI InChI=1S/C7H15NO4/c9-2-1-4-6(11)7(12)5(3-10)8-4/h4-12H,1-3H2/t4-,5-,6-,7-/m1/s1
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n/an/a 3.20E+5n/an/an/an/an/an/a



Hokuriku University

Curated by ChEMBL


Assay Description
Inhibition of rat epididymis beta-mannosidase assessed as p-nitrophenol release after 30 mins by spectrophotometry


J Nat Prod 65: 1875-81 (2002)


Article DOI: 10.1021/np020296h
BindingDB Entry DOI: 10.7270/Q2NC60Z4
More data for this
Ligand-Target Pair
Beta-mannosidase


(Rattus norvegicus)
BDBM50242065
PNG
(CHEMBL449851 | alpha-1-C-(2-Hydroxypropyl)-1,4-did...)
Show SMILES CC(O)C[C@H]1N[C@H](CO)[C@@H](O)[C@@H]1O |r|
Show InChI InChI=1S/C8H17NO4/c1-4(11)2-5-7(12)8(13)6(3-10)9-5/h4-13H,2-3H2,1H3/t4?,5-,6-,7-,8-/m1/s1
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n/an/a 6.10E+5n/an/an/an/an/an/a



Hokuriku University

Curated by ChEMBL


Assay Description
Inhibition of rat epididymis beta-mannosidase by spectrophotometry


J Nat Prod 67: 846-50 (2004)


Article DOI: 10.1021/np0499721
BindingDB Entry DOI: 10.7270/Q2Q52PD8
More data for this
Ligand-Target Pair