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SMILES: C[C@H](Nc1cc(nc(n1)N1CCc2c(C1)cccc2-c1ccc(cn1)C(F)(F)F)C(N)=O)C(N)=O

InChI Key: InChIKey=ZLMXMGFQERVQES-LBPRGKRZSA-N

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 = 457081   
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
Sodium channel protein type 9 subunit alpha


(Homo sapiens (Human))		BDBM457081
PNG
((S)-6-((1-amino-1-oxopropan- 2-yl)amino)-2-(5-(5- ...)
Show SMILES C[C@H](Nc1cc(nc(n1)N1CCc2c(C1)cccc2-c1ccc(cn1)C(F)(F)F)C(N)=O)C(N)=O |r|
Show InChI InChI=1S/C23H22F3N7O2/c1-12(20(27)34)30-19-9-18(21(28)35)31-22(32-19)33-8-7-15-13(11-33)3-2-4-16(15)17-6-5-14(10-29-17)23(24,25)26/h2-6,9-10,12H,7-8,11H2,1H3,(H2,27,34)(H2,28,35)(H,30,31,32)/t12-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
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PC cid
PC sid
UniChem
US Patent
n/an/a>2.00E+4n/an/an/an/an/an/a



Purdue Pharma L.P.

US Patent


Assay Description
The assay buffer was formulated by removing 120 mL from a 1 L bottle of fresh, sterile dH2O (Mediatech, Herndon, Va.) and adding 100 mL of 10×HBSS th...

US Patent US10738026 (2020)

More data for this
Ligand-Target Pair