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BDBM218574 US9284333, 16ni::US9884860, Example 16ni

SMILES: CC[C@@H](NC(=O)c1cc(C(=O)N2CCC[C@@H]2C)c2COCCn12)c1ccccc1C(F)(F)F

InChI Key: InChIKey=SHILZLXEZORMIR-HNAYVOBHSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 218574   
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 protein TASK-1


(Homo sapiens (Human))
BDBM218574
PNG
(US9284333, 16ni | US9884860, Example 16ni)
Show SMILES CC[C@@H](NC(=O)c1cc(C(=O)N2CCC[C@@H]2C)c2COCCn12)c1ccccc1C(F)(F)F
Show InChI InChI=1S/C24H28F3N3O3/c1-3-19(16-8-4-5-9-18(16)24(25,26)27)28-22(31)20-13-17(21-14-33-12-11-30(20)21)23(32)29-10-6-7-15(29)2/h4-5,8-9,13,15,19H,3,6-7,10-12,14H2,1-2H3,(H,28,31)/t15-,19+/m0/s1
PDB

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UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 290n/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 protein TASK-1


(Homo sapiens (Human))
BDBM218574
PNG
(US9284333, 16ni | US9884860, Example 16ni)
Show SMILES CC[C@@H](NC(=O)c1cc(C(=O)N2CCC[C@@H]2C)c2COCCn12)c1ccccc1C(F)(F)F
Show InChI InChI=1S/C24H28F3N3O3/c1-3-19(16-8-4-5-9-18(16)24(25,26)27)28-22(31)20-13-17(21-14-33-12-11-30(20)21)23(32)29-10-6-7-15(29)2/h4-5,8-9,13,15,19H,3,6-7,10-12,14H2,1-2H3,(H,28,31)/t15-,19+/m0/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 290n/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