null
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:
Target/Host (Institution) | Ligand | Target/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 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
CMP-N-acetylneuraminate-beta-1,4-galactoside alpha-2,3-sialyltransferase (Rattus norvegicus) | BDBM50565994 (CHEMBL3596261) | 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 | |||||||||||||
Sialyltransferase ST3Gal-I (Rattus norvegicus) | BDBM50565994 (CHEMBL3596261) | KEGG UniProtKB/TrEMBL DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | n/a | n/a | 1.32E+4 | n/a | n/a | n/a | n/a | n/a | n/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 (CHEMBL3596261) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | n/a | n/a | 1.50E+3 | n/a | n/a | n/a | n/a | n/a | n/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 |