BDBM50217907 3-(4-chloro-benzenesulfonyl)-1-(1-methyl-pyrrolidin-3-yl)-1H-pyrrolo[2,3-b]pyridine::CHEMBL394231

SMILES: CN1CCC(C1)n1cc(c2cccnc12)S(=O)(=O)c1ccc(Cl)cc1

InChI Key: InChIKey=NXTNPTMFPFGUNT-UHFFFAOYSA-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 = 50217907   

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))	BDBM50217907 (3-(4-chloro-benzenesulfonyl)-1-(1-methyl-pyrrolidi...) Show SMILES CN1CCC(C1)n1cc(c2cccnc12)S(=O)(=O)c1ccc(Cl)cc1 |w:4.6| Show InChI InChI=1S/C18H18ClN3O2S/c1-21-10-8-14(11-21)22-12-17(16-3-2-9-20-18(16)22)25(23,24)15-6-4-13(19)5-7-15/h2-7,9,12,14H,8,10-11H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.17	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Islamic Azad University Curated by ChEMBL					Assay Description Binding affinity to 5HT6 receptor				Eur J Med Chem 45: 3911-5 (2010) Article DOI: 10.1016/j.ejmech.2010.05.045 BindingDB Entry DOI: 10.7270/Q27945XK
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 6 (Homo sapiens (Human))	BDBM50217907 (3-(4-chloro-benzenesulfonyl)-1-(1-methyl-pyrrolidi...) Show SMILES CN1CCC(C1)n1cc(c2cccnc12)S(=O)(=O)c1ccc(Cl)cc1 |w:4.6| Show InChI InChI=1S/C18H18ClN3O2S/c1-21-10-8-14(11-21)22-12-17(16-3-2-9-20-18(16)22)25(23,24)15-6-4-13(19)5-7-15/h2-7,9,12,14H,8,10-11H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	4.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Displacement of [3H]LSD from cloned human 5HT6 expressed in HeLa cells				Bioorg Med Chem 15: 6208-26 (2007) Article DOI: 10.1016/j.bmc.2007.06.024 BindingDB Entry DOI: 10.7270/Q2HT2P2G
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 6 (Homo sapiens (Human))	BDBM50217907 (3-(4-chloro-benzenesulfonyl)-1-(1-methyl-pyrrolidi...) Show SMILES CN1CCC(C1)n1cc(c2cccnc12)S(=O)(=O)c1ccc(Cl)cc1 |w:4.6| Show InChI InChI=1S/C18H18ClN3O2S/c1-21-10-8-14(11-21)22-12-17(16-3-2-9-20-18(16)22)25(23,24)15-6-4-13(19)5-7-15/h2-7,9,12,14H,8,10-11H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	95	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Antagonist activity at human 5HT6 expressed in HeLa cells assessed as intracellular cAMP level by radioimmunoassay				Bioorg Med Chem 15: 6208-26 (2007) Article DOI: 10.1016/j.bmc.2007.06.024 BindingDB Entry DOI: 10.7270/Q2HT2P2G
					More data for this Ligand-Target Pair