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SMILES: COCCOCCOc1ncc(Cl)c2n(c(CO)cc(=O)c12)-c1c(Cl)cccc1Cl

InChI Key:

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 585690   
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
G protein-activated inward rectifier potassium channel 1/4


(Homo sapiens (Human))
BDBM585690
PNG
(8-chloro-1-(2,6-dichlorophenyl)-2- (hydroxymethyl)...)
Show SMILES COCCOCCOc1ncc(Cl)c2n(c(CO)cc(=O)c12)-c1c(Cl)cccc1Cl |(-5.36,-8.74,;-4.27,-7.65,;-4.67,-6.16,;-3.58,-5.07,;-3.98,-3.58,;-2.64,-2.81,;-2.64,-1.27,;-1.31,-.5,;-1.31,1.04,;-2.64,1.81,;-2.64,3.35,;-1.31,4.12,;-1.31,5.66,;.02,3.35,;1.36,4.12,;2.69,3.35,;4.02,4.12,;5.36,3.35,;2.69,1.81,;1.36,1.04,;1.36,-.5,;.02,1.81,;1.36,5.66,;.02,6.43,;-1.31,7.2,;.02,7.97,;1.36,8.74,;2.69,7.97,;2.69,6.43,;4.02,5.66,)|
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
US Patent
n/an/a 73n/an/an/an/an/an/a


TBA

Assay Description
Quattro is controlled using IonWorks v2 software to perform the following steps:a. Add 3.5 ul cells plus 3.5 ul external buffer to wells of Quattro P...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2K64NXF
More data for this
Ligand-Target Pair