BDBM50206161 1-(4-(methylthio)benzyl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole::CHEMBL391191

SMILES: CSc1ccc(CC2NCCc3c2[nH]c2ccccc32)cc1

InChI Key: InChIKey=LZTWMUALJKFQJM-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 = 50206161   

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 7 (Homo sapiens (Human))	BDBM50206161 (1-(4-(methylthio)benzyl)-2,3,4,9-tetrahydro-1H-pyr...) Show SMILES CSc1ccc(CC2NCCc3c2[nH]c2ccccc32)cc1 |w:7.6| Show InChI InChI=1S/C19H20N2S/c1-22-14-8-6-13(7-9-14)12-18-19-16(10-11-20-18)15-4-2-3-5-17(15)21-19/h2-9,18,20-21H,10-12H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	170	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Strathclyde Curated by ChEMBL					Assay Description Displacement of [3H]5CT from 5HT7 receptor expressed in HEK293 cells				Bioorg Med Chem Lett 17: 2649-55 (2007) Article DOI: 10.1016/j.bmcl.2007.01.093 BindingDB Entry DOI: 10.7270/Q2WQ03F0
					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor M4 (Homo sapiens (Human))	BDBM50206161 (1-(4-(methylthio)benzyl)-2,3,4,9-tetrahydro-1H-pyr...) Show SMILES CSc1ccc(CC2NCCc3c2[nH]c2ccccc32)cc1 |w:7.6| Show InChI InChI=1S/C19H20N2S/c1-22-14-8-6-13(7-9-14)12-18-19-16(10-11-20-18)15-4-2-3-5-17(15)21-19/h2-9,18,20-21H,10-12H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	6.80E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Strathclyde Curated by ChEMBL					Assay Description Displacement of [3H]N-methylscopolamine from muscarinic M4 receptor				Bioorg Med Chem Lett 17: 2649-55 (2007) Article DOI: 10.1016/j.bmcl.2007.01.093 BindingDB Entry DOI: 10.7270/Q2WQ03F0
					More data for this Ligand-Target Pair