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SMILES: CCNc1ncc2c(n1)N(C)CCN(c1cccc(COC(CCNCCF)c3cccs3)c1)C2=O

InChI Key: InChIKey=QRAORHCJNXMYOA-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 436569   
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 [25-1103]


(Homo sapiens (Human))		BDBM436569
PNG
(2-(ethylamino)-6-(3- ((3-((2-fluoroethyl) amino)-1...)
Show SMILES CCNc1ncc2c(n1)N(C)CCN(c1cccc(COC(CCNCCF)c3cccs3)c1)C2=O
Show InChI InChI=1S/C26H33FN6O2S/c1-3-29-26-30-17-21-24(31-26)32(2)13-14-33(25(21)34)20-7-4-6-19(16-20)18-35-22(9-11-28-12-10-27)23-8-5-15-36-23/h4-8,15-17,22,28H,3,9-14,18H2,1-2H3,(H,29,30,31)
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
US Patent
 300n/an/an/an/an/an/an/an/a



ESTEVE PHARMACEUTICALS, S.A.

US Patent


Assay Description
α2δ-1: Binding Assay to Human α2δ-1 Subunit of Cav2.2 Calcium Channel.Human α2δ-1 enriched membranes (2.5 μg) were...

US Patent US10590140 (2020)


BindingDB Entry DOI: 10.7270/Q2WM1HGR
More data for this
Ligand-Target Pair