BDBM50364320 CHEMBL1949772

SMILES: Cc1ccc(cc1)S(=O)(=O)c1ccc2[C@@H]3CCNC[C@@H]3Oc2c1

InChI Key: InChIKey=XMWLBQRRZONGKP-WMZOPIPTSA-N

Data: 2 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 3 hits for monomerid = 50364320   

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 6 (Homo sapiens (Human))	BDBM50364320 (CHEMBL1949772) Show SMILES Cc1ccc(cc1)S(=O)(=O)c1ccc2[C@@H]3CCNC[C@@H]3Oc2c1 |r| Show InChI InChI=1S/C18H19NO3S/c1-12-2-4-13(5-3-12)23(20,21)14-6-7-15-16-8-9-19-11-18(16)22-17(15)10-14/h2-7,10,16,18-19H,8-9,11H2,1H3/t16-,18-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	64	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Cephalon, Inc. Curated by ChEMBL					Assay Description Displacement of [3H]LSD from human recombinant 5HT6 receptor				Bioorg Med Chem Lett 22: 1421-6 (2012) Article DOI: 10.1016/j.bmcl.2011.12.026 BindingDB Entry DOI: 10.7270/Q20Z73R1
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 6 (RAT)	BDBM50364320 (CHEMBL1949772) Show SMILES Cc1ccc(cc1)S(=O)(=O)c1ccc2[C@@H]3CCNC[C@@H]3Oc2c1 |r| Show InChI InChI=1S/C18H19NO3S/c1-12-2-4-13(5-3-12)23(20,21)14-6-7-15-16-8-9-19-11-18(16)22-17(15)10-14/h2-7,10,16,18-19H,8-9,11H2,1H3/t16-,18-/m0/s1	Reactome pathway UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	236	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Cephalon, Inc. Curated by ChEMBL					Assay Description Displacement of [3H]LSD from rat recombinant 5HT6 receptor				Bioorg Med Chem Lett 22: 1421-6 (2012) Article DOI: 10.1016/j.bmcl.2011.12.026 BindingDB Entry DOI: 10.7270/Q20Z73R1
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 6 (Homo sapiens (Human))	BDBM50364320 (CHEMBL1949772) Show SMILES Cc1ccc(cc1)S(=O)(=O)c1ccc2[C@@H]3CCNC[C@@H]3Oc2c1 |r| Show InChI InChI=1S/C18H19NO3S/c1-12-2-4-13(5-3-12)23(20,21)14-6-7-15-16-8-9-19-11-18(16)22-17(15)10-14/h2-7,10,16,18-19H,8-9,11H2,1H3/t16-,18-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	245	n/a	n/a	n/a	n/a	n/a	n/a
Cephalon, Inc. Curated by ChEMBL					Assay Description Antagonist activity at human 5HT6 receptor expressed in human astrocytoma cells assessed as inhibition of cAMP production				Bioorg Med Chem Lett 22: 1421-6 (2012) Article DOI: 10.1016/j.bmcl.2011.12.026 BindingDB Entry DOI: 10.7270/Q20Z73R1
					More data for this Ligand-Target Pair