BDBM50398972 CHEMBL2179678

SMILES: Cn1cc2c(OCC3CCN(CCc4ccccc4)CC3)nc3ccccc3c2c1

InChI Key: InChIKey=FJLWRVJMCXVJOE-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 = 50398972   

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
5-hydroxytryptamine receptor 4 (5-HT4) (Homo sapiens (Human))	BDBM50398972 (CHEMBL2179678) Show SMILES Cn1cc2c(OCC3CCN(CCc4ccccc4)CC3)nc3ccccc3c2c1 Show InChI InChI=1S/C26H29N3O/c1-28-17-23-22-9-5-6-10-25(22)27-26(24(23)18-28)30-19-21-12-15-29(16-13-21)14-11-20-7-3-2-4-8-20/h2-10,17-18,21H,11-16,19H2,1H3	UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Angelini Santa Palomba Research Center Curated by ChEMBL					Assay Description Displacement of [3H](1-(2-(methylsulfonamido)ethyl)piperidin-4-yl)methyl 1-methyl-1H-indole-3-carboxylate from human 5HT4R expressed in HEK293 cells				J Med Chem 55: 9446-66 (2012) Article DOI: 10.1021/jm300573d BindingDB Entry DOI: 10.7270/Q27082JT
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 2A (Homo sapiens (Human))	BDBM50398972 (CHEMBL2179678) Show SMILES Cn1cc2c(OCC3CCN(CCc4ccccc4)CC3)nc3ccccc3c2c1 Show InChI InChI=1S/C26H29N3O/c1-28-17-23-22-9-5-6-10-25(22)27-26(24(23)18-28)30-19-21-12-15-29(16-13-21)14-11-20-7-3-2-4-8-20/h2-10,17-18,21H,11-16,19H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	79.4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Angelini Santa Palomba Research Center Curated by ChEMBL					Assay Description Displacement of [3H]ketanserin from human 5HT2AR expressed in CHOK1 cells				J Med Chem 55: 9446-66 (2012) Article DOI: 10.1021/jm300573d BindingDB Entry DOI: 10.7270/Q27082JT
					More data for this Ligand-Target Pair