BDBM50088689 1-{3-[5-(2-Ethoxy-phenyl)-[1,3,4]thiadiazol-2-ylsulfanyl]-propyl}-4-(2-methoxy-phenyl)-piperazine::CHEMBL418343

SMILES: CCOc1ccccc1-c1nnc(SCCCN2CCN(CC2)c2ccccc2OC)s1

InChI Key: InChIKey=LEDCXZMBIUZBMF-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 = 50088689   

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 1A (Rattus norvegicus (rat))	BDBM50088689 (1-{3-[5-(2-Ethoxy-phenyl)-[1,3,4]thiadiazol-2-ylsu...) Show SMILES CCOc1ccccc1-c1nnc(SCCCN2CCN(CC2)c2ccccc2OC)s1 Show InChI InChI=1S/C24H30N4O2S2/c1-3-30-21-11-6-4-9-19(21)23-25-26-24(32-23)31-18-8-13-27-14-16-28(17-15-27)20-10-5-7-12-22(20)29-2/h4-7,9-12H,3,8,13-18H2,1-2H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	6.80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Catania Curated by ChEMBL					Assay Description Displacement of [3H]-8-OH-DPAT from 5-hydroxytryptamine 1A receptor of rat hippocampus membranes				Bioorg Med Chem Lett 10: 1089-92 (2000) BindingDB Entry DOI: 10.7270/Q25D8R2B
					More data for this Ligand-Target Pair
Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor (Rattus norvegicus (rat)-Rattus norvegicus (Rat))	BDBM50088689 (1-{3-[5-(2-Ethoxy-phenyl)-[1,3,4]thiadiazol-2-ylsu...) Show SMILES CCOc1ccccc1-c1nnc(SCCCN2CCN(CC2)c2ccccc2OC)s1 Show InChI InChI=1S/C24H30N4O2S2/c1-3-30-21-11-6-4-9-19(21)23-25-26-24(32-23)31-18-8-13-27-14-16-28(17-15-27)20-10-5-7-12-22(20)29-2/h4-7,9-12H,3,8,13-18H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	32	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Catania Curated by ChEMBL					Assay Description Displacement of [3H]prazosin from Alpha-1 adrenergic receptor of rat cortex membranes				Bioorg Med Chem Lett 10: 1089-92 (2000) BindingDB Entry DOI: 10.7270/Q25D8R2B
					More data for this Ligand-Target Pair