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SMILES: CC[C@@H](NC(=O)c1cc(C(=O)N2CCC[C@@H]2C)n2CCOCc12)c1cnc(OC)c(Cl)c1

InChI Key: InChIKey=UBUZPRWNQWEPLH-KBXCAEBGSA-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 3 hits for monomerid = 218252   
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 voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM218252
PNG
(US9284333, 16b | US9884860, Example 16b)
Show SMILES CC[C@@H](NC(=O)c1cc(C(=O)N2CCC[C@@H]2C)n2CCOCc12)c1cnc(OC)c(Cl)c1 |r|
Show InChI InChI=1S/C23H29ClN4O4/c1-4-18(15-10-17(24)22(31-3)25-12-15)26-21(29)16-11-19(28-8-9-32-13-20(16)28)23(30)27-7-5-6-14(27)2/h10-12,14,18H,4-9,13H2,1-3H3,(H,26,29)/t14-,18+/m0/s1
PDB
MMDB

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UniProtKB/SwissProt

B.MOAD
DrugBank
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GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a>1.00E+4n/an/an/an/an/a25



Sanofi

US Patent


Assay Description
The effect of compounds of the formula I on the cloned human cardiac hERG channel was evaluated in an in vitro model using a whole-cell patch-clampin...


US Patent US9284333 (2016)


BindingDB Entry DOI: 10.7270/Q2FJ2FMC
More data for this
Ligand-Target Pair
Potassium channel subfamily K member 3


(Homo sapiens (Human))
BDBM218252
PNG
(US9284333, 16b | US9884860, Example 16b)
Show SMILES CC[C@@H](NC(=O)c1cc(C(=O)N2CCC[C@@H]2C)n2CCOCc12)c1cnc(OC)c(Cl)c1 |r|
Show InChI InChI=1S/C23H29ClN4O4/c1-4-18(15-10-17(24)22(31-3)25-12-15)26-21(29)16-11-19(28-8-9-32-13-20(16)28)23(30)27-7-5-6-14(27)2/h10-12,14,18H,4-9,13H2,1-3H3,(H,26,29)/t14-,18+/m0/s1
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 61n/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))
BDBM218252
PNG
(US9284333, 16b | US9884860, Example 16b)
Show SMILES CC[C@@H](NC(=O)c1cc(C(=O)N2CCC[C@@H]2C)n2CCOCc12)c1cnc(OC)c(Cl)c1 |r|
Show InChI InChI=1S/C23H29ClN4O4/c1-4-18(15-10-17(24)22(31-3)25-12-15)26-21(29)16-11-19(28-8-9-32-13-20(16)28)23(30)27-7-5-6-14(27)2/h10-12,14,18H,4-9,13H2,1-3H3,(H,26,29)/t14-,18+/m0/s1
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 61n/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