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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

InChI Key:

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50565994   
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
CMP-N-acetylneuraminate-beta-1,4-galactoside alpha-2,3-sialyltransferase


(Rattus norvegicus)
BDBM50565994
PNG
(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/an/a 900n/an/an/an/an/an/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
Sialyltransferase ST3Gal-I


(Rattus norvegicus)
BDBM50565994
PNG
(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/TrEMBL

DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.32E+4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of rat alpha-2,3-O-ST3GALI assessed as reduction in sialylated-product formation using p-nitrophenyl T-antigen and CMP-NeuSAc incubated fo...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01477
BindingDB Entry DOI: 10.7270/Q2T43XVZ
More data for this
Ligand-Target Pair
Beta-galactoside alpha-2,6-sialyltransferase 1


(Homo sapiens (Human))
BDBM50565994
PNG
(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|
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.50E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human alpha-2,6-ST6GAL1 assessed as reduction in sialylated-product formation using Gal-beta1-4GlcNac and CMP-NeuSAc incubated for 15 m...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01477
BindingDB Entry DOI: 10.7270/Q2T43XVZ
More data for this
Ligand-Target Pair