BDBM50179327 7-benzyl-5,6,7,8-tetrahydro-2-phenylamino-4H-pyrido[4',3':4,5]thieno[2,3-d][1,3]oxazin-4-one::CHEMBL355626

SMILES: O=c1oc(Nc2ccccc2)nc2sc3CN(Cc4ccccc4)CCc3c12

InChI Key: InChIKey=NHAHPCBTIKODHT-UHFFFAOYSA-N

Data: 1 KI  1 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 = 50179327   

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
Cholesterol esterase (Bos taurus)	BDBM50179327 (7-benzyl-5,6,7,8-tetrahydro-2-phenylamino-4H-pyrid...) Show SMILES O=c1oc(Nc2ccccc2)nc2sc3CN(Cc4ccccc4)CCc3c12 Show InChI InChI=1S/C22H19N3O2S/c26-21-19-17-11-12-25(13-15-7-3-1-4-8-15)14-18(17)28-20(19)24-22(27-21)23-16-9-5-2-6-10-16/h1-10H,11-14H2,(H,23,24)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bonn Curated by ChEMBL					Assay Description Inhibitory activity against bovine pancreatic CEase in presence of pNPB chromogenic substrate by spectrophotometry				J Med Chem 48: 8270-88 (2005) Article DOI: 10.1021/jm0508639 BindingDB Entry DOI: 10.7270/Q2GQ6XB4
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50179327 (7-benzyl-5,6,7,8-tetrahydro-2-phenylamino-4H-pyrid...) Show SMILES O=c1oc(Nc2ccccc2)nc2sc3CN(Cc4ccccc4)CCc3c12 Show InChI InChI=1S/C22H19N3O2S/c26-21-19-17-11-12-25(13-15-7-3-1-4-8-15)14-18(17)28-20(19)24-22(27-21)23-16-9-5-2-6-10-16/h1-10H,11-14H2,(H,23,24)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	940	n/a	n/a	n/a	n/a	n/a	n/a
University of Bonn Curated by ChEMBL					Assay Description Inhibitory activity AChE from Electrophorus electricus using ATCh substrate and DTNB by spectrophotometry				J Med Chem 48: 8270-88 (2005) Article DOI: 10.1021/jm0508639 BindingDB Entry DOI: 10.7270/Q2GQ6XB4
					More data for this Ligand-Target Pair