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SMILES: CNc1nc(NC[C@H](C)c2ccccc2)nc(NC2CCC(CC2)C(=O)NCc2ccccc2C(F)(F)F)n1

InChI Key:

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50566624   
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
Bifunctional epoxide hydrolase 2


(Homo sapiens (Human))		BDBM50566624
PNG
(CHEMBL4851172)
Show SMILES CNc1nc(NC[C@H](C)c2ccccc2)nc(NC2CCC(CC2)C(=O)NCc2ccccc2C(F)(F)F)n1 |r,wU:7.7,(18.77,-3.6,;17.44,-4.37,;17.44,-5.91,;18.78,-6.68,;18.78,-8.22,;20.12,-8.99,;21.45,-8.22,;22.78,-8.99,;22.78,-10.53,;24.12,-8.22,;25.45,-9,;26.78,-8.23,;26.78,-6.69,;25.44,-5.92,;24.11,-6.69,;17.45,-8.99,;16.12,-8.22,;14.79,-8.99,;13.45,-8.22,;12.12,-8.99,;10.79,-8.22,;10.79,-6.69,;12.12,-5.9,;13.45,-6.68,;9.45,-5.92,;9.45,-4.38,;8.12,-6.7,;6.78,-5.93,;5.45,-6.71,;4.12,-5.94,;2.79,-6.71,;2.79,-8.26,;4.12,-9.03,;5.46,-8.26,;6.79,-9.02,;7.55,-7.68,;8.33,-9.01,;6.8,-10.56,;16.11,-6.68,)|
PDB

KEGG

UniProtKB/SwissProt

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antibodypedia
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 39n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of human sEH using EnzChek as substrate preincubated with enzyme for 5 mins followed by substrate addition and measured every 30 secs for ...

Citation and Details

Article DOI: 10.1016/j.bmc.2021.116216
BindingDB Entry DOI: 10.7270/Q22J6GNB
More data for this
Ligand-Target Pair