Found 16 hits Enz. Inhib. hit(s) with Target = 'CMP-N-acetylneuraminate-beta-1,4-galactoside alpha-2,3-sialyltransferase' Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
CMP-N-acetylneuraminate-beta-1,4-galactoside alpha-2,3-sialyltransferase
(Rattus norvegicus) | BDBM50310540
(((2R,3S,4R,5R)-5-(4-amino-2-oxopyrimidin-1(2H)-yl)...)Show SMILES Nc1ccn([C@@H]2O[C@H](COP(O)(O)=O)[C@@H](O)[C@H]2O)c(=O)n1 |r| Show InChI InChI=1S/C9H14N3O8P/c10-5-1-2-12(9(15)11-5)8-7(14)6(13)4(20-8)3-19-21(16,17)18/h1-2,4,6-8,13-14H,3H2,(H2,10,11,15)(H2,16,17,18)/t4-,6-,7-,8-/m1/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet 
| Purchase
CHEMBL
MCE
KEGG
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| PubMed
| 6.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Colorado
Curated by ChEMBL
| Assay Description
Inhibitory activity evaluated against alpha-2,3-sialyltransferase from rat liver |
Bioorg Med Chem Lett 13: 301-4 (2002)
BindingDB Entry DOI: 10.7270/Q2FJ2HBM |
More data for this
Ligand-Target Pair | |
CMP-N-acetylneuraminate-beta-1,4-galactoside alpha-2,3-sialyltransferase
(Rattus norvegicus) | BDBM50366833
(CHEMBL608928)Show SMILES Nc1ccn(C2O[C@H](COP(O)(=O)N[C@@H](Cc3c[nH]c4ccccc34)C(O)=O)[C@@H](O)[C@H]2O)c(=O)n1 |r| Show InChI InChI=1S/C20H24N5O9P/c21-15-5-6-25(20(30)23-15)18-17(27)16(26)14(34-18)9-33-35(31,32)24-13(19(28)29)7-10-8-22-12-4-2-1-3-11(10)12/h1-6,8,13-14,16-18,22,26-27H,7,9H2,(H,28,29)(H2,21,23,30)(H2,24,31,32)/t13-,14+,16+,17+,18?/m0/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 3.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Colorado
Curated by ChEMBL
| Assay Description
Inhibitory activity evaluated against alpha-2,3-sialyltransferase from rat liver |
Bioorg Med Chem Lett 13: 301-4 (2002)
BindingDB Entry DOI: 10.7270/Q2FJ2HBM |
More data for this
Ligand-Target Pair | |
CMP-N-acetylneuraminate-beta-1,4-galactoside alpha-2,3-sialyltransferase
(Rattus norvegicus) | BDBM50366837
(CHEMBL608619)Show SMILES Nc1ccn(C2O[C@H](COP(O)(=O)OCC(O)=O)[C@@H](O)[C@H]2O)c(=O)n1 |r| Show InChI InChI=1S/C11H16N3O10P/c12-6-1-2-14(11(19)13-6)10-9(18)8(17)5(24-10)3-22-25(20,21)23-4-7(15)16/h1-2,5,8-10,17-18H,3-4H2,(H,15,16)(H,20,21)(H2,12,13,19)/t5-,8-,9-,10?/m1/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 7.10E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Colorado
Curated by ChEMBL
| Assay Description
Inhibitory activity evaluated against alpha-2,3-sialyltransferase from rat liver |
Bioorg Med Chem Lett 13: 301-4 (2002)
BindingDB Entry DOI: 10.7270/Q2FJ2HBM |
More data for this
Ligand-Target Pair | |
CMP-N-acetylneuraminate-beta-1,4-galactoside alpha-2,3-sialyltransferase
(Rattus norvegicus) | BDBM50366832
(CHEMBL609516)Show SMILES CC(C)C[C@H](NP(O)(=O)OC[C@H]1OC([C@H](O)[C@@H]1O)n1ccc(N)nc1=O)C(O)=O |r| Show InChI InChI=1S/C15H25N4O9P/c1-7(2)5-8(14(22)23)18-29(25,26)27-6-9-11(20)12(21)13(28-9)19-4-3-10(16)17-15(19)24/h3-4,7-9,11-13,20-21H,5-6H2,1-2H3,(H,22,23)(H2,16,17,24)(H2,18,25,26)/t8-,9+,11+,12+,13?/m0/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 9.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Colorado
Curated by ChEMBL
| Assay Description
Inhibitory activity evaluated against alpha-2,3-sialyltransferase from rat liver |
Bioorg Med Chem Lett 13: 301-4 (2002)
BindingDB Entry DOI: 10.7270/Q2FJ2HBM |
More data for this
Ligand-Target Pair | |
CMP-N-acetylneuraminate-beta-1,4-galactoside alpha-2,3-sialyltransferase
(Rattus norvegicus) | BDBM50366836
(CHEMBL610554)Show SMILES C[C@H](NP(O)(=O)OC[C@H]1OC([C@H](O)[C@@H]1O)n1ccc(N)nc1=O)C(O)=O |r| Show InChI InChI=1S/C12H19N4O9P/c1-5(11(19)20)15-26(22,23)24-4-6-8(17)9(18)10(25-6)16-3-2-7(13)14-12(16)21/h2-3,5-6,8-10,17-18H,4H2,1H3,(H,19,20)(H2,13,14,21)(H2,15,22,23)/t5-,6+,8+,9+,10?/m0/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 2.30E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Colorado
Curated by ChEMBL
| Assay Description
Inhibitory activity evaluated against alpha-2,3-sialyltransferase from rat liver |
Bioorg Med Chem Lett 13: 301-4 (2002)
BindingDB Entry DOI: 10.7270/Q2FJ2HBM |
More data for this
Ligand-Target Pair | |
CMP-N-acetylneuraminate-beta-1,4-galactoside alpha-2,3-sialyltransferase
(Rattus norvegicus) | BDBM50366834
(CHEMBL609800)Show SMILES Nc1ccn(C2O[C@H](COP(O)(=O)N[C@@H](Cc3ccccc3)C(O)=O)[C@@H](O)[C@H]2O)c(=O)n1 |r| Show InChI InChI=1S/C18H23N4O9P/c19-13-6-7-22(18(27)20-13)16-15(24)14(23)12(31-16)9-30-32(28,29)21-11(17(25)26)8-10-4-2-1-3-5-10/h1-7,11-12,14-16,23-24H,8-9H2,(H,25,26)(H2,19,20,27)(H2,21,28,29)/t11-,12+,14+,15+,16?/m0/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 2.30E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Colorado
Curated by ChEMBL
| Assay Description
Inhibitory activity evaluated against alpha-2,3-sialyltransferase from rat liver |
Bioorg Med Chem Lett 13: 301-4 (2002)
BindingDB Entry DOI: 10.7270/Q2FJ2HBM |
More data for this
Ligand-Target Pair | |
CMP-N-acetylneuraminate-beta-1,4-galactoside alpha-2,3-sialyltransferase
(Rattus norvegicus) | BDBM50366835
(CHEMBL609514)Show SMILES Nc1ccn(C2O[C@H](COP(O)(=O)N[C@@H](CC(O)=O)C(O)=O)[C@@H](O)[C@H]2O)c(=O)n1 |r| Show InChI InChI=1S/C13H19N4O11P/c14-7-1-2-17(13(24)15-7)11-10(21)9(20)6(28-11)4-27-29(25,26)16-5(12(22)23)3-8(18)19/h1-2,5-6,9-11,20-21H,3-4H2,(H,18,19)(H,22,23)(H2,14,15,24)(H2,16,25,26)/t5-,6+,9+,10+,11?/m0/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 5.10E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Colorado
Curated by ChEMBL
| Assay Description
Inhibitory activity evaluated against alpha-2,3-sialyltransferase from rat liver |
Bioorg Med Chem Lett 13: 301-4 (2002)
BindingDB Entry DOI: 10.7270/Q2FJ2HBM |
More data for this
Ligand-Target Pair | |
CMP-N-acetylneuraminate-beta-1,4-galactoside alpha-2,3-sialyltransferase
(Rattus norvegicus) | BDBM50366838
(CHEMBL609215)Show SMILES Nc1ccn(C2O[C@H](COP(O)(=O)NCC(O)=O)[C@@H](O)[C@H]2O)c(=O)n1 |r| Show InChI InChI=1S/C11H17N4O9P/c12-6-1-2-15(11(20)14-6)10-9(19)8(18)5(24-10)4-23-25(21,22)13-3-7(16)17/h1-2,5,8-10,18-19H,3-4H2,(H,16,17)(H2,12,14,20)(H2,13,21,22)/t5-,8-,9-,10?/m1/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| 5.30E+6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Colorado
Curated by ChEMBL
| Assay Description
Inhibitory activity evaluated against alpha-2,3-sialyltransferase from rat liver |
Bioorg Med Chem Lett 13: 301-4 (2002)
BindingDB Entry DOI: 10.7270/Q2FJ2HBM |
More data for this
Ligand-Target Pair | |
CMP-N-acetylneuraminate-beta-1,4-galactoside alpha-2,3-sialyltransferase
(Rattus norvegicus) | BDBM50565989
(CHEMBL4798770)Show SMILES [H][C@@]1(CC[C@@]2([H])[C@]3([H])CC[C@]4([H])C[C@@H](CC[C@]4(C)[C@@]3([H])CC[C@]12C)OC(=O)[C@H](CC(O)=O)Nc1ccc([N+]([O-])=O)c2nonc12)[C@H](C)CCC(=O)OCCOCCN=[N+]=[N-] |r| | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 770 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of rat alpha-2,3-N-ST3GALIII assessed as reduction in sialylated-product formation using Gal-beta1-4Glc and CMP-NeuSAc incubated for 1.5 h... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01477
BindingDB Entry DOI: 10.7270/Q2T43XVZ |
More data for this
Ligand-Target Pair | |
CMP-N-acetylneuraminate-beta-1,4-galactoside alpha-2,3-sialyltransferase
(Rattus norvegicus) | BDBM50565988
(CHEMBL4785533)Show SMILES [H][C@@]1(CC[C@@]2([H])[C@]3([H])CC[C@]4([H])C[C@@H](CC[C@]4(C)[C@@]3([H])CC[C@]12C)OC(=O)[C@H](CC(O)=O)Nc1ccc([N+]([O-])=O)c2nonc12)[C@H](C)CCC(=O)OCCN=[N+]=[N-] |r| | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 800 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of rat alpha-2,3-N-ST3GALIII assessed as reduction in sialylated-product formation using Gal-beta1-4Glc and CMP-NeuSAc incubated for 1.5 h... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01477
BindingDB Entry DOI: 10.7270/Q2T43XVZ |
More data for this
Ligand-Target Pair | |
CMP-N-acetylneuraminate-beta-1,4-galactoside alpha-2,3-sialyltransferase
(Rattus norvegicus) | BDBM50565994
(CHEMBL3596261)Show SMILES [H][C@@]1(CC[C@@]2([H])[C@]3([H])CC[C@]4([H])C[C@@H](CC[C@]4(C)[C@@]3([H])CC[C@]12C)OC(=O)[C@H](CCC(O)=O)Nc1ccc([N+]([O-])=O)c2nonc12)[C@H](C)CCC(O)=O |r| | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 900 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of rat alpha-2,3-N-ST3GALIII assessed as reduction in sialylated-product formation using Gal-beta1-4Glc and CMP-NeuSAc incubated for 1.5 h... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01477
BindingDB Entry DOI: 10.7270/Q2T43XVZ |
More data for this
Ligand-Target Pair | |
CMP-N-acetylneuraminate-beta-1,4-galactoside alpha-2,3-sialyltransferase
(Rattus norvegicus) | BDBM50565992
(CHEMBL4795609)Show SMILES [H][C@@]1(CC[C@@]2([H])[C@]3([H])CC[C@]4([H])C[C@@H](CC[C@]4(C)[C@@]3([H])CC[C@]12C)OC(=O)[C@H](CC(O)=O)Nc1ccc([N+]([O-])=O)c2nonc12)[C@H](C)CCC(=O)OCCOCCOCCOCCOCCN=[N+]=[N-] |r| | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of rat alpha-2,3-N-ST3GALIII assessed as reduction in sialylated-product formation using Gal-beta1-4Glc and CMP-NeuSAc incubated for 1.5 h... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01477
BindingDB Entry DOI: 10.7270/Q2T43XVZ |
More data for this
Ligand-Target Pair | |
CMP-N-acetylneuraminate-beta-1,4-galactoside alpha-2,3-sialyltransferase
(Rattus norvegicus) | BDBM50565991
(CHEMBL4785375)Show SMILES [H][C@@]1(CC[C@@]2([H])[C@]3([H])CC[C@]4([H])C[C@@H](CC[C@]4(C)[C@@]3([H])CC[C@]12C)OC(=O)[C@H](CC(O)=O)Nc1ccc([N+]([O-])=O)c2nonc12)[C@H](C)CCC(=O)OCCOCCOCCOCCN=[N+]=[N-] |r| | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.01E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of rat alpha-2,3-N-ST3GALIII assessed as reduction in sialylated-product formation using Gal-beta1-4Glc and CMP-NeuSAc incubated for 1.5 h... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01477
BindingDB Entry DOI: 10.7270/Q2T43XVZ |
More data for this
Ligand-Target Pair | |
CMP-N-acetylneuraminate-beta-1,4-galactoside alpha-2,3-sialyltransferase
(Rattus norvegicus) | BDBM50565990
(CHEMBL4780118)Show SMILES [H][C@@]1(CC[C@@]2([H])[C@]3([H])CC[C@]4([H])C[C@@H](CC[C@]4(C)[C@@]3([H])CC[C@]12C)OC(=O)[C@H](CC(O)=O)Nc1ccc([N+]([O-])=O)c2nonc12)[C@H](C)CCC(=O)OCCOCCOCCN=[N+]=[N-] |r| | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.74E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of rat alpha-2,3-N-ST3GALIII assessed as reduction in sialylated-product formation using Gal-beta1-4Glc and CMP-NeuSAc incubated for 1.5 h... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01477
BindingDB Entry DOI: 10.7270/Q2T43XVZ |
More data for this
Ligand-Target Pair | |
CMP-N-acetylneuraminate-beta-1,4-galactoside alpha-2,3-sialyltransferase
(Rattus norvegicus) | BDBM50324493
(CHEMBL1214872 | Cytidine-5'-monophospho-5-(2-(4-((...)Show SMILES C[C@]12CC[C@H]3[C@@H](CCc4cc(O)ccc34)[C@@H]1CC[C@@]2(O)c1cn(CC(=O)N[C@@H]2[C@@H](O)C[C@](OP([O-])(=O)OC[C@H]3O[C@H]([C@H](O)[C@@H]3O)n3ccc(N)nc3=O)(O[C@H]2[C@H](O)[C@H](O)CO)C([O-])=O)nn1 |r| Show InChI InChI=1S/C40H54N7O18P/c1-38-9-6-21-20-5-3-19(49)12-18(20)2-4-22(21)23(38)7-10-39(38,59)27-14-46(45-44-27)15-29(52)43-30-24(50)13-40(36(56)57,64-34(30)31(53)25(51)16-48)65-66(60,61)62-17-26-32(54)33(55)35(63-26)47-11-8-28(41)42-37(47)58/h3,5,8,11-12,14,21-26,30-35,48-51,53-55,59H,2,4,6-7,9-10,13,15-17H2,1H3,(H,43,52)(H,56,57)(H,60,61)(H2,41,42,58)/p-2/t21-,22-,23+,24+,25-,26-,30-,31-,32-,33-,34-,35-,38+,39-,40-/m1/s1 | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 8.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Hokkaido University
Curated by ChEMBL
| Assay Description
Inhibition of rat recombinant alpha 2,3-(N)-sialyltransferase 3 |
J Med Chem 53: 5607-19 (2010)
Article DOI: 10.1021/jm100612r
BindingDB Entry DOI: 10.7270/Q2WS8TFD |
More data for this
Ligand-Target Pair | |
CMP-N-acetylneuraminate-beta-1,4-galactoside alpha-2,3-sialyltransferase
(Rattus norvegicus) | BDBM50565993
(CHEMBL4797481)Show SMILES [H][C@@]1(CC[C@@]2([H])[C@]3([H])CC[C@]4([H])C[C@@H](CC[C@]4(C)[C@@]3([H])CC[C@]12C)OC(=O)[C@@H](N)CC(O)=O)[C@H](C)CCC(O)=O |r| | KEGG
UniProtKB/SwissProt
GoogleScholar
AffyNet
| Purchase
MCE
KEGG
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.20E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of rat alpha-2,3-N-ST3GALIII assessed as reduction in sialylated-product formation using Gal-beta1-4Glc and CMP-NeuSAc incubated for 1.5 h... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01477
BindingDB Entry DOI: 10.7270/Q2T43XVZ |
More data for this
Ligand-Target Pair | |
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