BDBM50417099 CHEMBL1255823

SMILES: Brc1ccc(NC(=O)OCCCc2cccnc2)cc1

InChI Key: InChIKey=JZSFIMMYDQYNAN-UHFFFAOYSA-N

Data: 2 KI  1 Kd

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 3 hits for monomerid = 50417099   

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
Neuronal acetylcholine receptor protein alpha-7 subunit (Homo sapiens (Human))	BDBM50417099 (CHEMBL1255823) Show SMILES Brc1ccc(NC(=O)OCCCc2cccnc2)cc1 Show InChI InChI=1S/C15H15BrN2O2/c16-13-5-7-14(8-6-13)18-15(19)20-10-2-4-12-3-1-9-17-11-12/h1,3,5-9,11H,2,4,10H2,(H,18,19)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	6.92E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
VU University Amsterdam Curated by ChEMBL					Assay Description Displacement of [3H]-MLA from human alpha7 nAChR expressed in human SH-SY5Y cells				J Med Chem 53: 7192-201 (2010) Article DOI: 10.1021/jm100834y BindingDB Entry DOI: 10.7270/Q21J9C1V
					More data for this Ligand-Target Pair
Acetylcholine Binding protein (Lymnaea stagnalis)	BDBM50417099 (CHEMBL1255823) Show SMILES Brc1ccc(NC(=O)OCCCc2cccnc2)cc1 Show InChI InChI=1S/C15H15BrN2O2/c16-13-5-7-14(8-6-13)18-15(19)20-10-2-4-12-3-1-9-17-11-12/h1,3,5-9,11H,2,4,10H2,(H,18,19)	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
VU University Amsterdam Curated by ChEMBL					Assay Description Displacement of [3H]epibatidine from Lymnaea stagnalis His6-AChBP expressed in Bac-to-Bac baculovirus expression system				J Med Chem 53: 7192-201 (2010) Article DOI: 10.1021/jm100834y BindingDB Entry DOI: 10.7270/Q21J9C1V
					More data for this Ligand-Target Pair
Acetylcholine Binding protein (Lymnaea stagnalis)	BDBM50417099 (CHEMBL1255823) Show SMILES Brc1ccc(NC(=O)OCCCc2cccnc2)cc1 Show InChI InChI=1S/C15H15BrN2O2/c16-13-5-7-14(8-6-13)18-15(19)20-10-2-4-12-3-1-9-17-11-12/h1,3,5-9,11H,2,4,10H2,(H,18,19)	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	5.01E+4	n/a	n/a	n/a	n/a	n/a
VU University Amsterdam Curated by ChEMBL					Assay Description Binding affinity to Lymnaea stagnalis His6-AChBP expressed in Bac-to-Bac baculovirus expression system by surface plasmon resonance biosensor assay				J Med Chem 53: 7192-201 (2010) Article DOI: 10.1021/jm100834y BindingDB Entry DOI: 10.7270/Q21J9C1V
					More data for this Ligand-Target Pair