Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 1B' and Ligand = 'BDBM50060441'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
5-hydroxytryptamine receptor 1B (Homo sapiens (Human))	BDBM50060441 (3-[2-(4-Methyl-piperazin-1-yl)-ethyl]-5-[1,2,4]tri...) Show SMILES CN1CCN(CCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1 Show InChI InChI=1S/C17H22N6/c1-21-6-8-22(9-7-21)5-4-14-11-18-17-3-2-15(10-16(14)17)23-12-19-20-13-23/h2-3,10-13,18H,4-9H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	304	n/a	n/a	n/a	n/a	n/a	n/a
Merck, Sharp and Dohme Research Laboratories Curated by ChEMBL					Assay Description Displacement of [3H]-5-HT binding from cloned human 5-hydroxytryptamine 1B receptor stably expressed in CHO cells.				J Med Chem 42: 691-705 (1999) Article DOI: 10.1021/jm980569z BindingDB Entry DOI: 10.7270/Q2ZG6RDW
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1B (Homo sapiens (Human))	BDBM50060441 (3-[2-(4-Methyl-piperazin-1-yl)-ethyl]-5-[1,2,4]tri...) Show SMILES CN1CCN(CCc2c[nH]c3ccc(cc23)-n2cnnc2)CC1 Show InChI InChI=1S/C17H22N6/c1-21-6-8-22(9-7-21)5-4-14-11-18-17-3-2-15(10-16(14)17)23-12-19-20-13-23/h2-3,10-13,18H,4-9H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	310	n/a	n/a	n/a	n/a	n/a	n/a
Merck, Sharp and Dohme Research Laboratories Curated by ChEMBL					Assay Description Displacement of [3H]-5-HT from human 5-hydroxytryptamine 1B receptor expressed in CHO cells				J Med Chem 40: 3501-3 (1997) Article DOI: 10.1021/jm9704560 BindingDB Entry DOI: 10.7270/Q2DZ07D8
					More data for this Ligand-Target Pair