BDBM235266 US9365558, 89::US9365558, 92::US9822074, 92

SMILES: Fc1cc(OCCCCCC(F)(F)F)ccc1[C@@]1(CC(c2ccn(n2)C2CC2)=C(C(=O)NS(=O)(=O)C2CC2)C(=O)N1)C(F)(F)F

InChI Key: InChIKey=BPEQURMQZNVJCL-SANMLTNESA-N

Data: 4 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 235266   

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
Alpha-1,6-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase (Homo sapiens (Human))	BDBM235266 (US9365558, 89 | US9365558, 92 | US9822074, 92) Show SMILES Fc1cc(OCCCCCC(F)(F)F)ccc1[C@@]1(CC(c2ccn(n2)C2CC2)=C(C(=O)NS(=O)(=O)C2CC2)C(=O)N1)C(F)(F)F |r,t:30| Show InChI InChI=1S/C28H29F7N4O5S/c29-21-14-17(44-13-3-1-2-11-27(30,31)32)6-9-20(21)26(28(33,34)35)15-19(22-10-12-39(37-22)16-4-5-16)23(24(40)36-26)25(41)38-45(42,43)18-7-8-18/h6,9-10,12,14,16,18H,1-5,7-8,11,13,15H2,(H,36,40)(H,38,41)/t26-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	6	n/a	n/a	n/a	n/a	7.4	65
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
Alpha-1,6-mannosyl-glycoprotein 2-beta-N-acetylglucosaminyltransferase (Homo sapiens (Human))	BDBM235266 (US9365558, 89 | US9365558, 92 | US9822074, 92) Show SMILES Fc1cc(OCCCCCC(F)(F)F)ccc1[C@@]1(CC(c2ccn(n2)C2CC2)=C(C(=O)NS(=O)(=O)C2CC2)C(=O)N1)C(F)(F)F |r,t:30| Show InChI InChI=1S/C28H29F7N4O5S/c29-21-14-17(44-13-3-1-2-11-27(30,31)32)6-9-20(21)26(28(33,34)35)15-19(22-10-12-39(37-22)16-4-5-16)23(24(40)36-26)25(41)38-45(42,43)18-7-8-18/h6,9-10,12,14,16,18H,1-5,7-8,11,13,15H2,(H,36,40)(H,38,41)/t26-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	6	n/a	n/a	n/a	n/a	n/a	n/a
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 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))	BDBM235266 (US9365558, 89 | US9365558, 92 | US9822074, 92) Show SMILES Fc1cc(OCCCCCC(F)(F)F)ccc1[C@@]1(CC(c2ccn(n2)C2CC2)=C(C(=O)NS(=O)(=O)C2CC2)C(=O)N1)C(F)(F)F |r,t:30| Show InChI InChI=1S/C28H29F7N4O5S/c29-21-14-17(44-13-3-1-2-11-27(30,31)32)6-9-20(21)26(28(33,34)35)15-19(22-10-12-39(37-22)16-4-5-16)23(24(40)36-26)25(41)38-45(42,43)18-7-8-18/h6,9-10,12,14,16,18H,1-5,7-8,11,13,15H2,(H,36,40)(H,38,41)/t26-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	6	n/a	n/a	n/a	n/a	n/a	n/a
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 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))	BDBM235266 (US9365558, 89 | US9365558, 92 | US9822074, 92) Show SMILES Fc1cc(OCCCCCC(F)(F)F)ccc1[C@@]1(CC(c2ccn(n2)C2CC2)=C(C(=O)NS(=O)(=O)C2CC2)C(=O)N1)C(F)(F)F |r,t:30| Show InChI InChI=1S/C28H29F7N4O5S/c29-21-14-17(44-13-3-1-2-11-27(30,31)32)6-9-20(21)26(28(33,34)35)15-19(22-10-12-39(37-22)16-4-5-16)23(24(40)36-26)25(41)38-45(42,43)18-7-8-18/h6,9-10,12,14,16,18H,1-5,7-8,11,13,15H2,(H,36,40)(H,38,41)/t26-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	6	n/a	n/a	n/a	n/a	7.4	65
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