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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Endothelial lipase' and Ligand = 'BDBM187291'   
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
Endothelial lipase


(Homo sapiens (Human))
BDBM187291
PNG
(US9169240, 31 | US9169240, 38 | US9169240, 40)
Show SMILES CC1(Cc2nnc(o2)C(=O)c2nc3ccc(cc3s2)-c2ccccc2)NC(=O)N(CC(F)(F)F)C1=O
Show InChI InChI=1S/C23H16F3N5O4S/c1-22(20(33)31(21(34)28-22)11-23(24,25)26)10-16-29-30-18(35-16)17(32)19-27-14-8-7-13(9-15(14)36-19)12-5-3-2-4-6-12/h2-9H,10-11H2,1H3,(H,28,34)
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a<10n/an/an/an/a8.0n/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The enzymatic assay was measured using white, opaque 96-well half area plates. Each well contained 60 μL of assay buffer (50 mM HEPES pH 8.0, 50...


US Patent US9169240 (2015)


BindingDB Entry DOI: 10.7270/Q2W66JK8
More data for this
Ligand-Target Pair
Endothelial lipase


(Homo sapiens (Human))
BDBM187291
PNG
(US9169240, 31 | US9169240, 38 | US9169240, 40)
Show SMILES CC1(Cc2nnc(o2)C(=O)c2nc3ccc(cc3s2)-c2ccccc2)NC(=O)N(CC(F)(F)F)C1=O
Show InChI InChI=1S/C23H16F3N5O4S/c1-22(20(33)31(21(34)28-22)11-23(24,25)26)10-16-29-30-18(35-16)17(32)19-27-14-8-7-13(9-15(14)36-19)12-5-3-2-4-6-12/h2-9H,10-11H2,1H3,(H,28,34)
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a<10n/an/an/an/a8.0n/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The enzymatic assay was measured using white, opaque 96-well half area plates. Each well contained 60 μL of assay buffer (50 mM HEPES pH 8.0, 50...


US Patent US9169240 (2015)


BindingDB Entry DOI: 10.7270/Q2W66JK8
More data for this
Ligand-Target Pair
Endothelial lipase


(Homo sapiens (Human))
BDBM187291
PNG
(US9169240, 31 | US9169240, 38 | US9169240, 40)
Show SMILES CC1(Cc2nnc(o2)C(=O)c2nc3ccc(cc3s2)-c2ccccc2)NC(=O)N(CC(F)(F)F)C1=O
Show InChI InChI=1S/C23H16F3N5O4S/c1-22(20(33)31(21(34)28-22)11-23(24,25)26)10-16-29-30-18(35-16)17(32)19-27-14-8-7-13(9-15(14)36-19)12-5-3-2-4-6-12/h2-9H,10-11H2,1H3,(H,28,34)
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 11n/an/an/an/a8.0n/a



Bristol-Myers Squibb Company

US Patent


Assay Description
The enzymatic assay was measured using white, opaque 96-well half area plates. Each well contained 60 μL of assay buffer (50 mM HEPES pH 8.0, 50...


US Patent US9169240 (2015)


BindingDB Entry DOI: 10.7270/Q2W66JK8
More data for this
Ligand-Target Pair