BDBM50122878 4-Amino-5-chloro-2,3-dihydro-benzofuran-7-carboxylic acid [2-(tetrahydro-pyrrolizin-7a-yl)-ethyl]-amide::CHEMBL325494

SMILES: Nc1c2CCOc2c(cc1Cl)C(=O)NCCC12CCCN1CCC2

InChI Key: InChIKey=PNROIWQNPITPBR-UHFFFAOYSA-N

Data: 1 KI  1 EC50

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 = 50122878   

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)/3c (5-HT3c)/3d (5-HT3d)/3e (5-HT3e) receptor (Homo sapiens (Human))	BDBM50122878 (4-Amino-5-chloro-2,3-dihydro-benzofuran-7-carboxyl...) Show SMILES Nc1c2CCOc2c(cc1Cl)C(=O)NCCC12CCCN1CCC2 Show InChI InChI=1S/C18H24ClN3O2/c19-14-11-13(16-12(15(14)20)3-10-24-16)17(23)21-7-6-18-4-1-8-22(18)9-2-5-18/h11H,1-10,20H2,(H,21,23)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	420	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
INSERM Curated by ChEMBL					Assay Description Compound was tested for selectivity against 5-hydroxytryptamine 3 receptor binding affinity				J Med Chem 46: 319-44 (2003) BindingDB Entry DOI: 10.7270/Q2T72J6J
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 4 (5-HT4) (Homo sapiens (Human))	BDBM50122878 (4-Amino-5-chloro-2,3-dihydro-benzofuran-7-carboxyl...) Show SMILES Nc1c2CCOc2c(cc1Cl)C(=O)NCCC12CCCN1CCC2 Show InChI InChI=1S/C18H24ClN3O2/c19-14-11-13(16-12(15(14)20)3-10-24-16)17(23)21-7-6-18-4-1-8-22(18)9-2-5-18/h11H,1-10,20H2,(H,21,23)	UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	n/a	n/a	14	n/a	n/a	n/a	n/a
INSERM Curated by ChEMBL					Assay Description Compound was tested for 5-hydroxytryptamine 4 binding affinity				J Med Chem 46: 319-44 (2003) BindingDB Entry DOI: 10.7270/Q2T72J6J
					More data for this Ligand-Target Pair