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BDBM50194511 (3S,4S)-methyl 5-(diisopropylamino)-5-oxo-3-phenyl-4-(pyridin-3-yl)pentanoate::CHEMBL385676

SMILES: COC(=O)C[C@@H]([C@H](C(=O)N(C(C)C)C(C)C)c1cccnc1)c1ccccc1

InChI Key: InChIKey=KVSRYMGXCMOBPD-IFMALSPDSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50194511   
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))
BDBM50194511
PNG
((3S,4S)-methyl 5-(diisopropylamino)-5-oxo-3-phenyl...)
Show SMILES COC(=O)C[C@@H]([C@H](C(=O)N(C(C)C)C(C)C)c1cccnc1)c1ccccc1
Show InChI InChI=1S/C23H30N2O3/c1-16(2)25(17(3)4)23(27)22(19-12-9-13-24-15-19)20(14-21(26)28-5)18-10-7-6-8-11-18/h6-13,15-17,20,22H,14H2,1-5H3/t20-,22-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.70E+3n/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