BDBM50077816 3-[3-(4-Benzyloxy-piperidin-1-yl)-2-fluoro-propyl]-5-[1,2,4]triazol-4-yl-1H-indole::CHEMBL305062

SMILES: FC(CN1CCC(CC1)OCc1ccccc1)Cc1c[nH]c2ccc(cc12)-n1cnnc1

InChI Key: InChIKey=ROFCSBBSQIIZMM-UHFFFAOYSA-N

Data: 2 IC50

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 = 50077816   

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 1D (Homo sapiens (Human))	BDBM50077816 (3-[3-(4-Benzyloxy-piperidin-1-yl)-2-fluoro-propyl]...) Show SMILES FC(CN1CCC(CC1)OCc1ccccc1)Cc1c[nH]c2ccc(cc12)-n1cnnc1 Show InChI InChI=1S/C25H28FN5O/c26-21(15-30-10-8-23(9-11-30)32-16-19-4-2-1-3-5-19)12-20-14-27-25-7-6-22(13-24(20)25)31-17-28-29-18-31/h1-7,13-14,17-18,21,23,27H,8-12,15-16H2	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	30	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
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1B (Homo sapiens (Human))	BDBM50077816 (3-[3-(4-Benzyloxy-piperidin-1-yl)-2-fluoro-propyl]...) Show SMILES FC(CN1CCC(CC1)OCc1ccccc1)Cc1c[nH]c2ccc(cc12)-n1cnnc1 Show InChI InChI=1S/C25H28FN5O/c26-21(15-30-10-8-23(9-11-30)32-16-19-4-2-1-3-5-19)12-20-14-27-25-7-6-22(13-24(20)25)31-17-28-29-18-31/h1-7,13-14,17-18,21,23,27H,8-12,15-16H2	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	3.00E+3	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 1B receptor expressed in CHO cells				J Med Chem 42: 2087-104 (1999) Article DOI: 10.1021/jm981133m BindingDB Entry DOI: 10.7270/Q2765DHF
					More data for this Ligand-Target Pair