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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Alpha-1,6-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase' and Ligand = 'BDBM235180'   
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
Alpha-1,6-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM235180
PNG
(US9365558, 3 | US9822074, 3)
Show SMILES Cc1ccc(cc1)C1=C(C(=O)NS(=O)(=O)C2CC2)C(=O)N[C@@](C1)(c1ncc(CCCCCCC(F)(F)F)s1)C(F)(F)F |r,c:8|
Show InChI InChI=1S/C27H29F6N3O4S2/c1-16-7-9-17(10-8-16)20-14-25(27(31,32)33,35-22(37)21(20)23(38)36-42(39,40)19-11-12-19)24-34-15-18(41-24)6-4-2-3-5-13-26(28,29)30/h7-10,15,19H,2-6,11-14H2,1H3,(H,35,37)(H,36,38)/t25-/m0/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 9n/an/an/an/an/an/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCONŽ 96-well Polypropylene plates, in a total volume of 60 μL of 50 mM Potassium Phosphat...


US Patent US9822074 (2017)


BindingDB Entry DOI: 10.7270/Q2K939TM
More data for this
Ligand-Target Pair
Alpha-1,6-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase


(Homo sapiens (Human))
BDBM235180
PNG
(US9365558, 3 | US9822074, 3)
Show SMILES Cc1ccc(cc1)C1=C(C(=O)NS(=O)(=O)C2CC2)C(=O)N[C@@](C1)(c1ncc(CCCCCCC(F)(F)F)s1)C(F)(F)F |r,c:8|
Show InChI InChI=1S/C27H29F6N3O4S2/c1-16-7-9-17(10-8-16)20-14-25(27(31,32)33,35-22(37)21(20)23(38)36-42(39,40)19-11-12-19)24-34-15-18(41-24)6-4-2-3-5-13-26(28,29)30/h7-10,15,19H,2-6,11-14H2,1H3,(H,35,37)(H,36,38)/t25-/m0/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 9n/an/an/an/a7.465



Bristol-Myers Squibb Company

US Patent


Assay Description
The MGAT enzyme reactions were performed in Corning FALCON® 96-well Polypropylene plates, in a total volume of 60 μL of 50 mM Potassium Phosph...


US Patent US9365558 (2016)


BindingDB Entry DOI: 10.7270/Q2XS5T8B
More data for this
Ligand-Target Pair