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BDBM50194516 CHEMBL217684::N,N-diisopropyl-3-phenyl-4-(4-phenylbutanamido)-2-(pyridin-3-yl)butanamide

SMILES: CC(C)N(C(C)C)C(=O)C(C(CNC(=O)CCCc1ccccc1)c1ccccc1)c1cccnc1

InChI Key: InChIKey=PNEMSBZLOXDGQB-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50194516   
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-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50194516
PNG
(CHEMBL217684 | N,N-diisopropyl-3-phenyl-4-(4-pheny...)
Show SMILES CC(C)N(C(C)C)C(=O)C(C(CNC(=O)CCCc1ccccc1)c1ccccc1)c1cccnc1
Show InChI InChI=1S/C31H39N3O2/c1-23(2)34(24(3)4)31(36)30(27-18-12-20-32-21-27)28(26-16-9-6-10-17-26)22-33-29(35)19-11-15-25-13-7-5-8-14-25/h5-10,12-14,16-18,20-21,23-24,28,30H,11,15,19,22H2,1-4H3,(H,33,35)
PDB

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 250n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair