BDBM50005839 (endo) 4-Amino-5-chloro-2-ethoxy-N-(hexahydro-pyrrolizin-1-yl)-benzamide::(exo) 4-Amino-5-chloro-2-ethoxy-N-(hexahydro-pyrrolizin-1-yl)-benzamide::CHEMBL35180

SMILES: CCOc1cc(N)c(Cl)cc1C(=O)NC1CCN2CCCC12

InChI Key: InChIKey=NCVKPYJAGSAQFM-UHFFFAOYSA-N

Data: 2 KI

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 = 50005839   

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
Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor (Rattus norvegicus-RAT)	BDBM50005839 ((endo) 4-Amino-5-chloro-2-ethoxy-N-(hexahydro-pyrr...) Show SMILES CCOc1cc(N)c(Cl)cc1C(=O)NC1CCN2CCCC12 Show InChI InChI=1S/C16H22ClN3O2/c1-2-22-15-9-12(18)11(17)8-10(15)16(21)19-13-5-7-20-6-3-4-14(13)20/h8-9,13-14H,2-7,18H2,1H3,(H,19,21)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	8	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Searle Research and Development Curated by ChEMBL					Assay Description Inhibition of [3H]GR-65630 binding to 5-hydroxytryptamine 3 receptor				J Med Chem 35: 1486-9 (1992) BindingDB Entry DOI: 10.7270/Q2CC11B3
					More data for this Ligand-Target Pair
Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor (Rattus norvegicus-RAT)	BDBM50005839 ((endo) 4-Amino-5-chloro-2-ethoxy-N-(hexahydro-pyrr...) Show SMILES CCOc1cc(N)c(Cl)cc1C(=O)NC1CCN2CCCC12 Show InChI InChI=1S/C16H22ClN3O2/c1-2-22-15-9-12(18)11(17)8-10(15)16(21)19-13-5-7-20-6-3-4-14(13)20/h8-9,13-14H,2-7,18H2,1H3,(H,19,21)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	99	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Searle Research and Development Curated by ChEMBL					Assay Description Inhibition of [3H]GR-65630 binding to 5-hydroxytryptamine 3 receptor				J Med Chem 35: 1486-9 (1992) BindingDB Entry DOI: 10.7270/Q2CC11B3
					More data for this Ligand-Target Pair