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Patent code USRE47740

Compile Data Set for Download or QSAR
Found 6 hits of Enzyme Inhibition Constant Data   
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
Interleukin-8 receptors, CXCR1/CXCR2


(Homo sapiens (Human))
BDBM50115210
PNG
(CHEMBL3609011 | USRE47740, Compound 19)
Show SMILES CN(Cc1ccc(cc1)B(O)O)c1ncc(cn1)C(=O)Nc1ccc(F)cc1
Show InChI InChI=1S/C19H18BFN4O3/c1-25(12-13-2-4-15(5-3-13)20(27)28)19-22-10-14(11-23-19)18(26)24-17-8-6-16(21)7-9-17/h2-11,27-28H,12H2,1H3,(H,24,26)
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US Patent
n/an/a 244n/an/an/an/an/an/a



Syntrix Biosystems Inc.

US Patent


Assay Description
Briefly, human neutrophils were suspended in HBSS− (without Ca2+ and Mg2+) containing 10 mM HEPES and FLIPR Calcium 3 dye (3.1107 cells in tot...


US Patent USRE47740 (2019)

More data for this
Ligand-Target Pair
Interleukin-8 receptors, CXCR1/CXCR2


(Homo sapiens (Human))
BDBM50115217
PNG
(CHEMBL3609005 | USRE47740, Compound 18)
Show SMILES CN(Cc1ccc(cc1)B(O)O)c1ccc(cn1)C(=O)Nc1ccc(F)cc1
Show InChI InChI=1S/C20H19BFN3O3/c1-25(13-14-2-5-16(6-3-14)21(27)28)19-11-4-15(12-23-19)20(26)24-18-9-7-17(22)8-10-18/h2-12,27-28H,13H2,1H3,(H,24,26)
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US Patent
n/an/a 247n/an/an/an/an/an/a



Syntrix Biosystems Inc.

US Patent


Assay Description
Briefly, human neutrophils were suspended in HBSS− (without Ca2+ and Mg2+) containing 10 mM HEPES and FLIPR Calcium 3 dye (3.1107 cells in tot...


US Patent USRE47740 (2019)

More data for this
Ligand-Target Pair
Interleukin-8 receptors, CXCR1/CXCR2


(Homo sapiens (Human))
BDBM420279
PNG
(SX-626 | USRE47740, Compound 9)
Show SMILES CN(Cc1ccccc1O)c1ccc(cn1)C(=O)Nc1ccc(F)cc1
Show InChI InChI=1S/C20H18FN3O2/c1-24(13-15-4-2-3-5-18(15)25)19-11-6-14(12-22-19)20(26)23-17-9-7-16(21)8-10-17/h2-12,25H,13H2,1H3,(H,23,26)
PDB

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n/an/a 586n/an/an/an/an/an/a



Syntrix Biosystems Inc.

US Patent


Assay Description
Briefly, human neutrophils were suspended in HBSS− (without Ca2+ and Mg2+) containing 10 mM HEPES and FLIPR Calcium 3 dye (3.1107 cells in tot...


US Patent USRE47740 (2019)

More data for this
Ligand-Target Pair
Interleukin-8 receptors, CXCR1/CXCR2


(Homo sapiens (Human))
BDBM50115221
PNG
(CHEMBL3609001 | USRE47740, Compound 8)
Show SMILES CN(Cc1ccccc1B(O)O)c1ccc(cn1)C(=O)Nc1ccc(F)cc1
Show InChI InChI=1S/C20H19BFN3O3/c1-25(13-15-4-2-3-5-18(15)21(27)28)19-11-6-14(12-23-19)20(26)24-17-9-7-16(22)8-10-17/h2-12,27-28H,13H2,1H3,(H,24,26)
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US Patent
n/an/a 1.00E+3n/an/an/an/an/an/a



Syntrix Biosystems Inc.

US Patent


Assay Description
Briefly, human neutrophils were suspended in HBSS− (without Ca2+ and Mg2+) containing 10 mM HEPES and FLIPR Calcium 3 dye (3.1107 cells in tot...


US Patent USRE47740 (2019)

More data for this
Ligand-Target Pair
Interleukin-8 receptors, CXCR1/CXCR2


(Homo sapiens (Human))
BDBM420280
PNG
(SX-627 | USRE47740, Compound 7)
Show SMILES CC1(C)OB(OC1(C)C)c1ccccc1CNc1ccc(cn1)C(=O)Nc1ccc(F)cc1
Show InChI InChI=1S/C25H27BFN3O3/c1-24(2)25(3,4)33-26(32-24)21-8-6-5-7-17(21)15-28-22-14-9-18(16-29-22)23(31)30-20-12-10-19(27)11-13-20/h5-14,16H,15H2,1-4H3,(H,28,29)(H,30,31)
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US Patent
n/an/a 1.50E+3n/an/an/an/an/an/a



Syntrix Biosystems Inc.

US Patent


Assay Description
Briefly, human neutrophils were suspended in HBSS− (without Ca2+ and Mg2+) containing 10 mM HEPES and FLIPR Calcium 3 dye (3.1107 cells in tot...


US Patent USRE47740 (2019)

More data for this
Ligand-Target Pair
Interleukin-8 receptors, CXCR1/CXCR2


(Homo sapiens (Human))
BDBM50115222
PNG
(CHEMBL3609000 | USRE47740, Compound 10)
Show SMILES OB(O)c1ccccc1CNc1ccc(cn1)C(=O)Nc1ccc(F)cc1
Show InChI InChI=1S/C19H17BFN3O3/c21-15-6-8-16(9-7-15)24-19(25)14-5-10-18(23-12-14)22-11-13-3-1-2-4-17(13)20(26)27/h1-10,12,26-27H,11H2,(H,22,23)(H,24,25)
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US Patent
n/an/a 1.70E+3n/an/an/an/an/an/a



Syntrix Biosystems Inc.

US Patent


Assay Description
Briefly, human neutrophils were suspended in HBSS− (without Ca2+ and Mg2+) containing 10 mM HEPES and FLIPR Calcium 3 dye (3.1107 cells in tot...


US Patent USRE47740 (2019)

More data for this
Ligand-Target Pair
* indicates data uncertainty>20%