BDBM50413522 CHEMBL511312

SMILES: CCN1CCC(COc2nc3ccsc3n3cccc23)CC1

InChI Key: InChIKey=RZFPSYUVZCCIFI-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 = 50413522   

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
HTR4 (GUINEA PIG)	BDBM50413522 (CHEMBL511312) Show SMILES CCN1CCC(COc2nc3ccsc3n3cccc23)CC1 Show InChI InChI=1S/C17H21N3OS/c1-2-19-9-5-13(6-10-19)12-21-16-15-4-3-8-20(15)17-14(18-16)7-11-22-17/h3-4,7-8,11,13H,2,5-6,9-10,12H2,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	19.1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Université de Caen Curated by ChEMBL					Assay Description Displacement of [3H]GR-113808 from 5HT4 receptor in guinea pig striatum membrane				Bioorg Med Chem 17: 2607-22 (2009) Article DOI: 10.1016/j.bmc.2008.11.045 BindingDB Entry DOI: 10.7270/Q2CJ8DCG
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 3A (Homo sapiens (Human))	BDBM50413522 (CHEMBL511312) Show SMILES CCN1CCC(COc2nc3ccsc3n3cccc23)CC1 Show InChI InChI=1S/C17H21N3OS/c1-2-19-9-5-13(6-10-19)12-21-16-15-4-3-8-20(15)17-14(18-16)7-11-22-17/h3-4,7-8,11,13H,2,5-6,9-10,12H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Université de Caen Curated by ChEMBL					Assay Description Displacement of [3H]granisetron from human recombinant 5HT3 receptor				Bioorg Med Chem 17: 2607-22 (2009) Article DOI: 10.1016/j.bmc.2008.11.045 BindingDB Entry DOI: 10.7270/Q2CJ8DCG
					More data for this Ligand-Target Pair