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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Hormone-sensitive lipase' and Ligand = 'BDBM99497'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Hormone-sensitive lipase


(Homo sapiens (Human))
BDBM99497
PNG
(US8501768, 25)
Show SMILES CC(C)(C)OC(=O)N1C[C@H]2CCN(C(=O)[C@H]2C1)c1ccc(OCC(F)(F)F)cc1 |r|
Show InChI InChI=1S/C20H25F3N2O4/c1-19(2,3)29-18(27)24-10-13-8-9-25(17(26)16(13)11-24)14-4-6-15(7-5-14)28-12-20(21,22)23/h4-7,13,16H,8-12H2,1-3H3/t13-,16+/m1/s1
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Similars

US Patent
n/an/a 334n/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
HSL enzyme activity was measured by a colorimetric assay.


US Patent US8501768 (2013)


BindingDB Entry DOI: 10.7270/Q26Q1VW3
More data for this
Ligand-Target Pair