BindingDB logo
myBDB logout

null

SMILES: CC[C@@H](NC(=O)c1cc(C(=O)NCC2CCCCC2)n2CCCCc12)c1ccccc1

InChI Key: InChIKey=XXNWMINYOUBVGX-JOCHJYFZSA-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 2 hits for monomerid = 218633   
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
Potassium channel subfamily K member 3


(Homo sapiens (Human))
BDBM218633
PNG
(US9284333, 16mp | US9884860, Example 16mp)
Show SMILES CC[C@@H](NC(=O)c1cc(C(=O)NCC2CCCCC2)n2CCCCc12)c1ccccc1 |r|
Show InChI InChI=1S/C26H35N3O2/c1-2-22(20-13-7-4-8-14-20)28-25(30)21-17-24(29-16-10-9-15-23(21)29)26(31)27-18-19-11-5-3-6-12-19/h4,7-8,13-14,17,19,22H,2-3,5-6,9-12,15-16,18H2,1H3,(H,27,31)(H,28,30)/t22-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 93n/an/an/an/an/a25



Sanofi

US Patent


Assay Description
Human TASK-1 channels were expressed in Xenopus oocytes. For this purpose, oocytes were isolated from Xenopus laevis and defoliculated. Subsequently,...


US Patent US9884860 (2018)


BindingDB Entry DOI: 10.7270/Q2862JGT
More data for this
Ligand-Target Pair
Potassium channel subfamily K member 3


(Homo sapiens (Human))
BDBM218633
PNG
(US9284333, 16mp | US9884860, Example 16mp)
Show SMILES CC[C@@H](NC(=O)c1cc(C(=O)NCC2CCCCC2)n2CCCCc12)c1ccccc1 |r|
Show InChI InChI=1S/C26H35N3O2/c1-2-22(20-13-7-4-8-14-20)28-25(30)21-17-24(29-16-10-9-15-23(21)29)26(31)27-18-19-11-5-3-6-12-19/h4,7-8,13-14,17,19,22H,2-3,5-6,9-12,15-16,18H2,1H3,(H,27,31)(H,28,30)/t22-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 93n/an/an/an/an/a25



Sanofi

US Patent


Assay Description
Human TASK-1 channels were expressed in Xenopus oocytes. For this purpose, oocytes were isolated from Xenopus laevis and defoliculated. Subsequently,...


US Patent US9284333 (2016)


BindingDB Entry DOI: 10.7270/Q2FJ2FMC
More data for this
Ligand-Target Pair