BDBM50139507 5-[1-(Naphthalene-1-sulfonyl)-1,2,3,6-tetrahydro-pyridin-4-yl]-3-(2-pyrrolidin-1-yl-ethyl)-1H-indole::CHEMBL162011

SMILES: O=S(=O)(N1CCC(=CC1)c1ccc2[nH]cc(CCN3CCCC3)c2c1)c1cccc2ccccc12

InChI Key: InChIKey=XVYKWJGEFVQTSM-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 = 50139507   

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))	BDBM50139507 (5-[1-(Naphthalene-1-sulfonyl)-1,2,3,6-tetrahydro-p...) Show SMILES O=S(=O)(N1CCC(=CC1)c1ccc2[nH]cc(CCN3CCCC3)c2c1)c1cccc2ccccc12 |c:6| Show InChI InChI=1S/C29H31N3O2S/c33-35(34,29-9-5-7-23-6-1-2-8-26(23)29)32-18-13-22(14-19-32)24-10-11-28-27(20-24)25(21-30-28)12-17-31-15-3-4-16-31/h1-2,5-11,13,20-21,30H,3-4,12,14-19H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	27	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))	BDBM50139507 (5-[1-(Naphthalene-1-sulfonyl)-1,2,3,6-tetrahydro-p...) Show SMILES O=S(=O)(N1CCC(=CC1)c1ccc2[nH]cc(CCN3CCCC3)c2c1)c1cccc2ccccc12 |c:6| Show InChI InChI=1S/C29H31N3O2S/c33-35(34,29-9-5-7-23-6-1-2-8-26(23)29)32-18-13-22(14-19-32)24-10-11-28-27(20-24)25(21-30-28)12-17-31-15-3-4-16-31/h1-2,5-11,13,20-21,30H,3-4,12,14-19H2	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	410	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