BDBM50117661 CHEMBL3613705

SMILES: COc1cccc(CC(=O)N2Cc3ccc(cc3C2)S(=O)(=O)Nc2cnn(C)n2)c1

InChI Key: InChIKey=VHUSJVLSWADZEZ-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50117661   

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
Beta-1,4-mannosyl-glycoprotein 4-beta-N-acetylglucosaminyltransferase (Homo sapiens (Human))	BDBM50117661 (CHEMBL3613705) Show SMILES COc1cccc(CC(=O)N2Cc3ccc(cc3C2)S(=O)(=O)Nc2cnn(C)n2)c1 Show InChI InChI=1S/C20H21N5O4S/c1-24-21-11-19(22-24)23-30(27,28)18-7-6-15-12-25(13-16(15)10-18)20(26)9-14-4-3-5-17(8-14)29-2/h3-8,10-11H,9,12-13H2,1-2H3,(H,22,23)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.98E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of MGAT3 (unknown origin) assessed effect on incorporation of [1-14C]decanoyl moiety into triacylglycerol using [1-14C]decanoyl-CoA and 1,...				J Med Chem 58: 7164-72 (2015) BindingDB Entry DOI: 10.7270/Q2F191HJ
					More data for this Ligand-Target Pair
Beta-1,4-mannosyl-glycoprotein 4-beta-N-acetylglucosaminyltransferase (Homo sapiens (Human))	BDBM50117661 (CHEMBL3613705) Show SMILES COc1cccc(CC(=O)N2Cc3ccc(cc3C2)S(=O)(=O)Nc2cnn(C)n2)c1 Show InChI InChI=1S/C20H21N5O4S/c1-24-21-11-19(22-24)23-30(27,28)18-7-6-15-12-25(13-16(15)10-18)20(26)9-14-4-3-5-17(8-14)29-2/h3-8,10-11H,9,12-13H2,1-2H3,(H,22,23)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.84E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of MGAT3 (unknown origin) assessed effect on incorporation of [1-14C]decanoyl moiety into triacylglycerol using [1-14C]decanoyl-CoA and 1,...				J Med Chem 58: 7164-72 (2015) BindingDB Entry DOI: 10.7270/Q2F191HJ
					More data for this Ligand-Target Pair