BDBM163715 5-{4-[4-(2-Fluorophenyl)piperazin-1-yl]butyl}-3-phenyl-4,5-dihydro-1,2,4-triazin-6(1H)-one (14)

SMILES: Fc1ccccc1N1CCN(CCCCC2NC(=NNC2=O)c2ccccc2)CC1

InChI Key: InChIKey=VEJNHADXNSRREG-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 = 163715   

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 7 (Homo sapiens (Human))	BDBM163715 (5-{4-[4-(2-Fluorophenyl)piperazin-1-yl]butyl}-3-ph...) Show SMILES Fc1ccccc1N1CCN(CCCCC2NC(=NNC2=O)c2ccccc2)CC1 |c:18| Show InChI InChI=1S/C23H28FN5O/c24-19-10-4-5-12-21(19)29-16-14-28(15-17-29)13-7-6-11-20-23(30)27-26-22(25-20)18-8-2-1-3-9-18/h1-5,8-10,12,20H,6-7,11,13-17H2,(H,25,26)(H,27,30)	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	100	-9.54	n/a	n/a	n/a	n/a	n/a	n/a	25
Jagiellonian University Medical College					Assay Description All assays were incubated in a total volume of 200 mL in 96-well microtiter plates for 1 h at 37 °C, except for 5-HT1ARs which were incubated at room...				Chem Biol Drug Des 86: 697-703 (2015) Article DOI: 10.1111/cbdd.12539 BindingDB Entry DOI: 10.7270/Q2DR2T86
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM163715 (5-{4-[4-(2-Fluorophenyl)piperazin-1-yl]butyl}-3-ph...) Show SMILES Fc1ccccc1N1CCN(CCCCC2NC(=NNC2=O)c2ccccc2)CC1 |c:18| Show InChI InChI=1S/C23H28FN5O/c24-19-10-4-5-12-21(19)29-16-14-28(15-17-29)13-7-6-11-20-23(30)27-26-22(25-20)18-8-2-1-3-9-18/h1-5,8-10,12,20H,6-7,11,13-17H2,(H,25,26)(H,27,30)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	119	-9.44	n/a	n/a	n/a	n/a	n/a	n/a	25
Jagiellonian University Medical College					Assay Description All assays were incubated in a total volume of 200 mL in 96-well microtiter plates for 1 h at 37 °C, except for 5-HT1ARs which were incubated at room...				Chem Biol Drug Des 86: 697-703 (2015) Article DOI: 10.1111/cbdd.12539 BindingDB Entry DOI: 10.7270/Q2DR2T86
					More data for this Ligand-Target Pair