BDBM50033436 CHEMBL120480::N-[2-(4-{2-[3-(2-Amino-ethyl)-1H-indol-5-yloxy]-acetyl}-piperazin-1-yl)-benzyl]-methanesulfonamide

SMILES: CS(=O)(=O)NCc1ccccc1N1CCN(CC1)C(=O)COc1ccc2[nH]cc(CCN)c2c1

InChI Key: InChIKey=WLZMILLXHAVQCT-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50033436   

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))	BDBM50033436 (CHEMBL120480 | N-[2-(4-{2-[3-(2-Amino-ethyl)-1H-in...) Show SMILES CS(=O)(=O)NCc1ccccc1N1CCN(CC1)C(=O)COc1ccc2[nH]cc(CCN)c2c1 Show InChI InChI=1S/C24H31N5O4S/c1-34(31,32)27-16-19-4-2-3-5-23(19)28-10-12-29(13-11-28)24(30)17-33-20-6-7-22-21(14-20)18(8-9-25)15-26-22/h2-7,14-15,26-27H,8-13,16-17,25H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	0.530	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Centre de Recherche Pierre Fabre Curated by ChEMBL					Assay Description Binding affinity for cloned human 5-hydroxytryptamine 1D receptor beta				J Med Chem 38: 3602-7 (1995) BindingDB Entry DOI: 10.7270/Q25M66C2
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1D (Homo sapiens (Human))	BDBM50033436 (CHEMBL120480 | N-[2-(4-{2-[3-(2-Amino-ethyl)-1H-in...) Show SMILES CS(=O)(=O)NCc1ccccc1N1CCN(CC1)C(=O)COc1ccc2[nH]cc(CCN)c2c1 Show InChI InChI=1S/C24H31N5O4S/c1-34(31,32)27-16-19-4-2-3-5-23(19)28-10-12-29(13-11-28)24(30)17-33-20-6-7-22-21(14-20)18(8-9-25)15-26-22/h2-7,14-15,26-27H,8-13,16-17,25H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Centre de Recherche Pierre Fabre Curated by ChEMBL					Assay Description Binding affinity to recombinant human 5-hydroxytryptamine 1D receptor alpha				J Med Chem 38: 3602-7 (1995) BindingDB Entry DOI: 10.7270/Q25M66C2
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50033436 (CHEMBL120480 | N-[2-(4-{2-[3-(2-Amino-ethyl)-1H-in...) Show SMILES CS(=O)(=O)NCc1ccccc1N1CCN(CC1)C(=O)COc1ccc2[nH]cc(CCN)c2c1 Show InChI InChI=1S/C24H31N5O4S/c1-34(31,32)27-16-19-4-2-3-5-23(19)28-10-12-29(13-11-28)24(30)17-33-20-6-7-22-21(14-20)18(8-9-25)15-26-22/h2-7,14-15,26-27H,8-13,16-17,25H2,1H3	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	5.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Centre de Recherche Pierre Fabre Curated by ChEMBL					Assay Description Binding affinity for cloned human 5-hydroxytryptamine 1A receptor				J Med Chem 38: 3602-7 (1995) BindingDB Entry DOI: 10.7270/Q25M66C2
					More data for this Ligand-Target Pair