BDBM50108796 2-{4-[3-(4-Bromo-benzyloxy)-piperidin-4-yl]-phenoxy}-1-naphthalen-2-yl-ethanone::CHEMBL152902

SMILES: Brc1ccc(CO[C@H]2CNCC[C@@H]2c2ccc(OCC(=O)c3ccc4ccccc4c3)cc2)cc1

InChI Key: InChIKey=NUIOTLSXESKUAC-DGPALRBDSA-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 = 50108796   

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
Pepsin A (Porcine)	BDBM50108796 (2-{4-[3-(4-Bromo-benzyloxy)-piperidin-4-yl]-phenox...) Show SMILES Brc1ccc(CO[C@H]2CNCC[C@@H]2c2ccc(OCC(=O)c3ccc4ccccc4c3)cc2)cc1 Show InChI InChI=1S/C30H28BrNO3/c31-26-11-5-21(6-12-26)19-35-30-18-32-16-15-28(30)23-9-13-27(14-10-23)34-20-29(33)25-8-7-22-3-1-2-4-24(22)17-25/h1-14,17,28,30,32H,15-16,18-20H2/t28-,30+/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Madison Curated by ChEMBL					Assay Description Inhibitory concentration against porcine pepsin				J Med Chem 45: 541-58 (2002) BindingDB Entry DOI: 10.7270/Q2M9080M
					More data for this Ligand-Target Pair
Rhizopuspepsin (Rhizopus microsporus var. chinensis)	BDBM50108796 (2-{4-[3-(4-Bromo-benzyloxy)-piperidin-4-yl]-phenox...) Show SMILES Brc1ccc(CO[C@H]2CNCC[C@@H]2c2ccc(OCC(=O)c3ccc4ccccc4c3)cc2)cc1 Show InChI InChI=1S/C30H28BrNO3/c31-26-11-5-21(6-12-26)19-35-30-18-32-16-15-28(30)23-9-13-27(14-10-23)34-20-29(33)25-8-7-22-3-1-2-4-24(22)17-25/h1-14,17,28,30,32H,15-16,18-20H2/t28-,30+/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Wisconsin-Madison Curated by ChEMBL					Assay Description Molar concentration required to inhibit 50% of the activating delayed-rectifier K+ current in isolated guinea pig ventricularmyocytes				J Med Chem 45: 541-58 (2002) BindingDB Entry DOI: 10.7270/Q2M9080M
					More data for this Ligand-Target Pair