BindingDB logo
myBDB logout

BDBM50145306 CHEMBL84067::Phenethyl-[6-(3-trifluoromethyl-[1,2,4]triazolo[3,4-a]phthalazin-6-yloxymethyl)-pyridin-2-ylmethyl]-amine

SMILES: FC(F)(F)c1nnc2c3ccccc3c(OCc3cccc(CNCCc4ccccc4)n3)nn12

InChI Key: InChIKey=HRGMZILFVYLNFG-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50145306   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Voltage-dependent calcium channel subunit alpha-2/delta-1


(Homo sapiens (Human))		BDBM50145306
PNG
(CHEMBL84067 | Phenethyl-[6-(3-trifluoromethyl-[1,2...)
Show SMILES FC(F)(F)c1nnc2c3ccccc3c(OCc3cccc(CNCCc4ccccc4)n3)nn12
Show InChI InChI=1S/C25H21F3N6O/c26-25(27,28)24-32-31-22-20-11-4-5-12-21(20)23(33-34(22)24)35-16-19-10-6-9-18(30-19)15-29-14-13-17-7-2-1-3-8-17/h1-12,29H,13-16H2
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

Similars
Article
PubMed
n/an/a 72n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity against alpha-2 delta-1 subunit of voltage gated subunit of Ca+2 channel in human

Bioorg Med Chem Lett 14: 2463-7 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.008
BindingDB Entry DOI: 10.7270/Q23X876G
More data for this
Ligand-Target Pair