Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = '5-hydroxytryptamine receptor 1D' and Ligand = 'BDBM50455554'   

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 1D (Homo sapiens (Human))	BDBM50455554 (CHEMBL2114038) Show SMILES F[C@H]1CN(CCCc2c[nH]c3ccc(cc23)-n2cnnc2)CC[C@@H]1NCc1ccccc1C(F)(F)F |r| Show InChI InChI=1S/C26H28F4N6/c27-23-15-35(11-9-25(23)32-14-19-4-1-2-6-22(19)26(28,29)30)10-3-5-18-13-31-24-8-7-20(12-21(18)24)36-16-33-34-17-36/h1-2,4,6-8,12-13,16-17,23,25,31-32H,3,5,9-11,14-15H2/t23-,25-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
Merck, Sharp & Dohme Research Laboratories Curated by ChEMBL					Assay Description Displacement of specific [3H]-5-HT binding to cloned human 5-hydroxytryptamine 1D receptor expressed in CHO cells				J Med Chem 42: 2087-104 (1999) Article DOI: 10.1021/jm981133m BindingDB Entry DOI: 10.7270/Q2765DHF
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