Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 1B' and Ligand = 'BDBM50060424'   

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))	BDBM50060424 (3-[2-((R)-3-Benzyloxy-pyrrolidin-1-yl)-ethyl]-5-[1...) Show SMILES C(Cc1c[nH]c2ccc(cc12)-n1cnnc1)N1CC[C@H](C1)OCc1ccccc1 Show InChI InChI=1S/C23H25N5O/c1-2-4-18(5-3-1)15-29-21-9-11-27(14-21)10-8-19-13-24-23-7-6-20(12-22(19)23)28-16-25-26-17-28/h1-7,12-13,16-17,21,24H,8-11,14-15H2/t21-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	145	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 the cloned human 5-hydroxytryptamine 1B receptor stably expressed in CHO cells				J Med Chem 42: 677-90 (1999) Article DOI: 10.1021/jm9805687 BindingDB Entry DOI: 10.7270/Q23777W5
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1B (Homo sapiens (Human))	BDBM50060424 (3-[2-((R)-3-Benzyloxy-pyrrolidin-1-yl)-ethyl]-5-[1...) Show SMILES C(Cc1c[nH]c2ccc(cc12)-n1cnnc1)N1CC[C@H](C1)OCc1ccccc1 Show InChI InChI=1S/C23H25N5O/c1-2-4-18(5-3-1)15-29-21-9-11-27(14-21)10-8-19-13-24-23-7-6-20(12-22(19)23)28-16-25-26-17-28/h1-7,12-13,16-17,21,24H,8-11,14-15H2/t21-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	146	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp and Dohme Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human cloned 5-hydroxytryptamine 1B receptor in CHO cells by [3H]-5-HT binding displacement.				J Med Chem 40: 3497-500 (1997) Article DOI: 10.1021/jm9704558 BindingDB Entry DOI: 10.7270/Q2JQ103J
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1B (Homo sapiens (Human))	BDBM50060424 (3-[2-((R)-3-Benzyloxy-pyrrolidin-1-yl)-ethyl]-5-[1...) Show SMILES C(Cc1c[nH]c2ccc(cc12)-n1cnnc1)N1CC[C@H](C1)OCc1ccccc1 Show InChI InChI=1S/C23H25N5O/c1-2-4-18(5-3-1)15-29-21-9-11-27(14-21)10-8-19-13-24-23-7-6-20(12-22(19)23)28-16-25-26-17-28/h1-7,12-13,16-17,21,24H,8-11,14-15H2/t21-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	146	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp and Dohme Research Laboratories Curated by ChEMBL					Assay Description Binding affinity to human cloned 5-hydroxytryptamine 1B receptor in CHO cells by [3H]-5-HT binding displacement.				J Med Chem 40: 3497-500 (1997) Article DOI: 10.1021/jm9704558 BindingDB Entry DOI: 10.7270/Q2JQ103J
					More data for this Ligand-Target Pair