BDBM50139506 5-[1-(4-Methoxy-benzenesulfonyl)-1,2,3,6-tetrahydro-pyridin-4-yl]-3-(2-pyrrolidin-1-yl-ethyl)-1H-indole::CHEMBL349675

SMILES: COc1ccc(cc1)S(=O)(=O)N1CCC(=CC1)c1ccc2[nH]cc(CCN3CCCC3)c2c1

InChI Key: InChIKey=DOHYKDWALRWYOK-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 = 50139506   

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 1D (Homo sapiens (Human))	BDBM50139506 (5-[1-(4-Methoxy-benzenesulfonyl)-1,2,3,6-tetrahydr...) Show SMILES COc1ccc(cc1)S(=O)(=O)N1CCC(=CC1)c1ccc2[nH]cc(CCN3CCCC3)c2c1 |c:15| Show InChI InChI=1S/C26H31N3O3S/c1-32-23-5-7-24(8-6-23)33(30,31)29-16-11-20(12-17-29)21-4-9-26-25(18-21)22(19-27-26)10-15-28-13-2-3-14-28/h4-9,11,18-19,27H,2-3,10,12-17H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	11	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Inc Curated by ChEMBL					Assay Description Binding affinity of the compound was evaluated at the cloned human 5-hydroxytryptamine 1D receptor				Bioorg Med Chem Lett 14: 727-9 (2004) BindingDB Entry DOI: 10.7270/Q2M32V5K
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1B (Homo sapiens (Human))	BDBM50139506 (5-[1-(4-Methoxy-benzenesulfonyl)-1,2,3,6-tetrahydr...) Show SMILES COc1ccc(cc1)S(=O)(=O)N1CCC(=CC1)c1ccc2[nH]cc(CCN3CCCC3)c2c1 |c:15| Show InChI InChI=1S/C26H31N3O3S/c1-32-23-5-7-24(8-6-23)33(30,31)29-16-11-20(12-17-29)21-4-9-26-25(18-21)22(19-27-26)10-15-28-13-2-3-14-28/h4-9,11,18-19,27H,2-3,10,12-17H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	140	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NPS Pharmaceuticals Inc Curated by ChEMBL					Assay Description Binding affinity of the compound was evaluated at the cloned human 5-hydroxytryptamine 1B receptor				Bioorg Med Chem Lett 14: 727-9 (2004) BindingDB Entry DOI: 10.7270/Q2M32V5K
					More data for this Ligand-Target Pair