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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](CC(O)=O)NC(=O)Cc1cc(=O)oc2cc(OC)ccc12)[C@H](C)CCC(=O)OCCOCCOCCOCCN=[N+]=[N-]

InChI Key:

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50566003   
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
Beta-galactoside alpha-2,6-sialyltransferase 1


(Homo sapiens (Human))
BDBM50566003
PNG
(CHEMBL4793980)
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)NC(=O)Cc1cc(=O)oc2cc(OC)ccc12)[C@H](C)CCC(=O)OCCOCCOCCOCCN=[N+]=[N-] |r|
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 5.00E+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