BDBM50088695 2-{3-[4-(2-Methoxy-phenyl)-piperazin-1-yl]-propylsulfanyl}-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-ylamine::CHEMBL11936

SMILES: COc1ccccc1N1CCN(CCCSc2nc(N)c3c(C)c(C)sc3n2)CC1

InChI Key: InChIKey=PVXJBAIAVSZADW-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 = 50088695   

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))	BDBM50088695 (2-{3-[4-(2-Methoxy-phenyl)-piperazin-1-yl]-propyls...) Show SMILES COc1ccccc1N1CCN(CCCSc2nc(N)c3c(C)c(C)sc3n2)CC1 Show InChI InChI=1S/C22H29N5OS2/c1-15-16(2)30-21-19(15)20(23)24-22(25-21)29-14-6-9-26-10-12-27(13-11-26)17-7-4-5-8-18(17)28-3/h4-5,7-8H,6,9-14H2,1-3H3,(H2,23,24,25)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.5	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))	BDBM50088695 (2-{3-[4-(2-Methoxy-phenyl)-piperazin-1-yl]-propyls...) Show SMILES COc1ccccc1N1CCN(CCCSc2nc(N)c3c(C)c(C)sc3n2)CC1 Show InChI InChI=1S/C22H29N5OS2/c1-15-16(2)30-21-19(15)20(23)24-22(25-21)29-14-6-9-26-10-12-27(13-11-26)17-7-4-5-8-18(17)28-3/h4-5,7-8H,6,9-14H2,1-3H3,(H2,23,24,25)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank 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
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