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SMILES: CC(C)[C@@H](NC(=O)c1cc(C(=O)N2CCC[C@@H]2C)c2COCCn12)c1ccc(F)cc1

InChI Key: InChIKey=NNOPDCQBSPUJPO-KSFYIVLOSA-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 = 218550   
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))
BDBM218550
PNG
(US9284333, 16lj | US9884860, Example 16lj)
Show SMILES CC(C)[C@@H](NC(=O)c1cc(C(=O)N2CCC[C@@H]2C)c2COCCn12)c1ccc(F)cc1 |r|
Show InChI InChI=1S/C24H30FN3O3/c1-15(2)22(17-6-8-18(25)9-7-17)26-23(29)20-13-19(21-14-31-12-11-28(20)21)24(30)27-10-4-5-16(27)3/h6-9,13,15-16,22H,4-5,10-12,14H2,1-3H3,(H,26,29)/t16-,22+/m0/s1
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 200n/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))
BDBM218550
PNG
(US9284333, 16lj | US9884860, Example 16lj)
Show SMILES CC(C)[C@@H](NC(=O)c1cc(C(=O)N2CCC[C@@H]2C)c2COCCn12)c1ccc(F)cc1 |r|
Show InChI InChI=1S/C24H30FN3O3/c1-15(2)22(17-6-8-18(25)9-7-17)26-23(29)20-13-19(21-14-31-12-11-28(20)21)24(30)27-10-4-5-16(27)3/h6-9,13,15-16,22H,4-5,10-12,14H2,1-3H3,(H,26,29)/t16-,22+/m0/s1
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 200n/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