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PubMed code 24974342

Compile data set for download or QSAR
Found 33 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, CXCR2


(Homo sapiens (Human))
BDBM50048182
PNG
(CHEMBL3310787)
Show SMILES OC[C@H]1C[C@@H]1c1nc(SCc2cccc(F)c2F)nc(O)c1C#N |r|
Show InChI InChI=1/C16H13F2N3O2S/c17-12-3-1-2-8(13(12)18)7-24-16-20-14(10-4-9(10)6-22)11(5-19)15(23)21-16/h1-3,9-10,22H,4,6-7H2,(H,20,21,23)/t9-,10+/s2
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n/an/a 6n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Antagonist activity against human recombinant CXCR2 receptor expressed in CHO cell membranes by SPA based [35S]GTPgammaS binding assay


Bioorg Med Chem Lett 24: 3285-90 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.011
More data for this
Ligand-Target Pair
Interleukin-8 receptors, CXCR2


(Homo sapiens (Human))
BDBM50048183
PNG
(CHEMBL3310788)
Show SMILES NC(=O)[C@H]1C[C@@H]1c1nc(SCc2cccc(F)c2F)nc(O)c1C#N |r|
Show InChI InChI=1/C16H12F2N4O2S/c17-11-3-1-2-7(12(11)18)6-25-16-21-13(8-4-9(8)14(20)23)10(5-19)15(24)22-16/h1-3,8-9H,4,6H2,(H2,20,23)(H,21,22,24)/t8-,9-/s2
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n/an/a 7n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Antagonist activity against human recombinant CXCR2 receptor expressed in CHO cell membranes by SPA based [35S]GTPgammaS binding assay


Bioorg Med Chem Lett 24: 3285-90 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.011
More data for this
Ligand-Target Pair
Interleukin-8 receptors, CXCR2


(Homo sapiens (Human))
BDBM50048181
PNG
(CHEMBL3310786)
Show SMILES OC(=O)[C@H]1C[C@@H]1c1nc(SCc2cccc(F)c2F)nc(O)c1C#N |r|
Show InChI InChI=1/C16H11F2N3O3S/c17-11-3-1-2-7(12(11)18)6-25-16-20-13(8-4-9(8)15(23)24)10(5-19)14(22)21-16/h1-3,8-9H,4,6H2,(H,23,24)(H,20,21,22)/t8-,9-/s2
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n/an/a 10n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Antagonist activity against human recombinant CXCR2 receptor expressed in CHO cell membranes by SPA based [35S]GTPgammaS binding assay


Bioorg Med Chem Lett 24: 3285-90 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.011
More data for this
Ligand-Target Pair
Interleukin-8 receptors, CXCR2


(Homo sapiens (Human))
BDBM50048228
PNG
(CHEMBL3310783)
Show SMILES Oc1nc(SCc2cccc(F)c2F)nc(C2CC2)c1C#N
Show InChI InChI=1S/C15H11F2N3OS/c16-11-3-1-2-9(12(11)17)7-22-15-19-13(8-4-5-8)10(6-18)14(21)20-15/h1-3,8H,4-5,7H2,(H,19,20,21)
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n/an/a 40n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Displacement of [125I]-GRO-alpha from human recombinant CXCR2 receptor expressed in CHO cell membranes


Bioorg Med Chem Lett 24: 3285-90 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.011
More data for this
Ligand-Target Pair
Interleukin-8 receptors, CXCR2


(Homo sapiens (Human))
BDBM50048228
PNG
(CHEMBL3310783)
Show SMILES Oc1nc(SCc2cccc(F)c2F)nc(C2CC2)c1C#N
Show InChI InChI=1S/C15H11F2N3OS/c16-11-3-1-2-9(12(11)17)7-22-15-19-13(8-4-5-8)10(6-18)14(21)20-15/h1-3,8H,4-5,7H2,(H,19,20,21)
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n/an/a 140n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Antagonist activity against human recombinant CXCR2 receptor expressed in CHO cell membranes by SPA based [35S]GTPgammaS binding assay


Bioorg Med Chem Lett 24: 3285-90 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.011
More data for this
Ligand-Target Pair
Interleukin-8 receptors, CXCR2


(Homo sapiens (Human))
BDBM50048224
PNG
(CHEMBL3310794)
Show SMILES Oc1cc(nc(SCc2cccc(F)c2F)n1)C1CC1
Show InChI InChI=1S/C14H12F2N2OS/c15-10-3-1-2-9(13(10)16)7-20-14-17-11(8-4-5-8)6-12(19)18-14/h1-3,6,8H,4-5,7H2,(H,17,18,19)
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n/an/a 320n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Antagonist activity against human recombinant CXCR2 receptor expressed in CHO cell membranes by SPA based [35S]GTPgammaS binding assay


Bioorg Med Chem Lett 24: 3285-90 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.011
More data for this
Ligand-Target Pair
Interleukin-8 receptors, CXCR2


(Homo sapiens (Human))
BDBM50048180
PNG
(CHEMBL3310785)
Show SMILES CCOC(=O)[C@H]1C[C@@H]1c1nc(SCc2cccc(F)c2F)nc(O)c1C#N |r|
Show InChI InChI=1/C18H15F2N3O3S/c1-2-26-17(25)11-6-10(11)15-12(7-21)16(24)23-18(22-15)27-8-9-4-3-5-13(19)14(9)20/h3-5,10-11H,2,6,8H2,1H3,(H,22,23,24)/t10-,11-/s2
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n/an/a 320n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Antagonist activity against human recombinant CXCR2 receptor expressed in CHO cell membranes by SPA based [35S]GTPgammaS binding assay


Bioorg Med Chem Lett 24: 3285-90 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.011
More data for this
Ligand-Target Pair
Interleukin-8 receptors, CXCR2


(Homo sapiens (Human))
BDBM50048184
PNG
(CHEMBL3310789)
Show SMILES Oc1nc(SCc2ccccc2)nc(C2CC2)c1C#N
Show InChI InChI=1S/C15H13N3OS/c16-8-12-13(11-6-7-11)17-15(18-14(12)19)20-9-10-4-2-1-3-5-10/h1-5,11H,6-7,9H2,(H,17,18,19)
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n/an/a 510n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Antagonist activity against human recombinant CXCR2 receptor expressed in CHO cell membranes by SPA based [35S]GTPgammaS binding assay


Bioorg Med Chem Lett 24: 3285-90 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.011
More data for this
Ligand-Target Pair
Interleukin-8 receptors, CXCR2


(Homo sapiens (Human))
BDBM50048244
PNG
(CHEMBL3310774)
Show SMILES COc1ccc(cc1)-c1nc(SCc2cccc(F)c2F)nc(O)c1C#N
Show InChI InChI=1S/C19H13F2N3O2S/c1-26-13-7-5-11(6-8-13)17-14(9-22)18(25)24-19(23-17)27-10-12-3-2-4-15(20)16(12)21/h2-8H,10H2,1H3,(H,23,24,25)
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n/an/a 710n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Antagonist activity against human recombinant CXCR2 receptor expressed in CHO cell membranes by SPA based [35S]GTPgammaS binding assay


Bioorg Med Chem Lett 24: 3285-90 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.011
More data for this
Ligand-Target Pair
Interleukin-8 receptors, CXCR2


(Homo sapiens (Human))
BDBM50048249
PNG
(CHEMBL3310777)
Show SMILES Oc1ccc(cc1)-c1nc(SCc2cccc(F)c2F)nc(O)c1C#N
Show InChI InChI=1S/C18H11F2N3O2S/c19-14-3-1-2-11(15(14)20)9-26-18-22-16(13(8-21)17(25)23-18)10-4-6-12(24)7-5-10/h1-7,24H,9H2,(H,22,23,25)
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n/an/a 780n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Antagonist activity against human recombinant CXCR2 receptor expressed in CHO cell membranes by SPA based [35S]GTPgammaS binding assay


Bioorg Med Chem Lett 24: 3285-90 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.011
More data for this
Ligand-Target Pair
Interleukin-8 receptors, CXCR2


(Homo sapiens (Human))
BDBM50048252
PNG
(CHEMBL3310780)
Show SMILES CC(C)c1nc(SCc2cccc(F)c2F)nc(O)c1C#N
Show InChI InChI=1S/C15H13F2N3OS/c1-8(2)13-10(6-18)14(21)20-15(19-13)22-7-9-4-3-5-11(16)12(9)17/h3-5,8H,7H2,1-2H3,(H,19,20,21)
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n/an/a 900n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Antagonist activity against human recombinant CXCR2 receptor expressed in CHO cell membranes by SPA based [35S]GTPgammaS binding assay


Bioorg Med Chem Lett 24: 3285-90 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.011
More data for this
Ligand-Target Pair
Interleukin-8 receptors, CXCR2


(Homo sapiens (Human))
BDBM50048180
PNG
(CHEMBL3310785)
Show SMILES CCOC(=O)[C@H]1C[C@@H]1c1nc(SCc2cccc(F)c2F)nc(O)c1C#N |r|
Show InChI InChI=1/C18H15F2N3O3S/c1-2-26-17(25)11-6-10(11)15-12(7-21)16(24)23-18(22-15)27-8-9-4-3-5-13(19)14(9)20/h3-5,10-11H,2,6,8H2,1H3,(H,22,23,24)/t10-,11-/s2
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n/an/a 1.30E+3n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Antagonist activity against human recombinant CXCR2 receptor expressed in CHO cell membranes by SPA based [35S]GTPgammaS binding assay


Bioorg Med Chem Lett 24: 3285-90 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.011
More data for this
Ligand-Target Pair
Interleukin-8 receptors, CXCR2


(Homo sapiens (Human))
BDBM50048225
PNG
(CHEMBL3311396)
Show SMILES Oc1nc(SCc2cccc(F)c2F)nc(C2CC2)c1Br
Show InChI InChI=1S/C14H11BrF2N2OS/c15-10-12(7-4-5-7)18-14(19-13(10)20)21-6-8-2-1-3-9(16)11(8)17/h1-3,7H,4-6H2,(H,18,19,20)
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n/an/a 1.40E+3n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Antagonist activity against human recombinant CXCR2 receptor expressed in CHO cell membranes by SPA based [35S]GTPgammaS binding assay


Bioorg Med Chem Lett 24: 3285-90 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.011
More data for this
Ligand-Target Pair
Interleukin-8 receptors, CXCR2


(Homo sapiens (Human))
BDBM50048242
PNG
(CHEMBL3310773)
Show SMILES Cc1ccc(cc1)-c1nc(SCc2cccc(F)c2F)nc(O)c1C#N
Show InChI InChI=1S/C19H13F2N3OS/c1-11-5-7-12(8-6-11)17-14(9-22)18(25)24-19(23-17)26-10-13-3-2-4-15(20)16(13)21/h2-8H,10H2,1H3,(H,23,24,25)
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n/an/a 1.40E+3n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Antagonist activity against human recombinant CXCR2 receptor expressed in CHO cell membranes by SPA based [35S]GTPgammaS binding assay


Bioorg Med Chem Lett 24: 3285-90 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.011
More data for this
Ligand-Target Pair
Interleukin-8 receptors, CXCR2


(Homo sapiens (Human))
BDBM50048180
PNG
(CHEMBL3310785)
Show SMILES CCOC(=O)[C@H]1C[C@@H]1c1nc(SCc2cccc(F)c2F)nc(O)c1C#N |r|
Show InChI InChI=1/C18H15F2N3O3S/c1-2-26-17(25)11-6-10(11)15-12(7-21)16(24)23-18(22-15)27-8-9-4-3-5-13(19)14(9)20/h3-5,10-11H,2,6,8H2,1H3,(H,22,23,24)/t10-,11-/s2
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n/an/a 1.50E+3n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Antagonist activity against human recombinant CXCR2 receptor expressed in CHO cell membranes by SPA based [35S]GTPgammaS binding assay


Bioorg Med Chem Lett 24: 3285-90 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.011
More data for this
Ligand-Target Pair
Interleukin-8 receptors, CXCR2


(Homo sapiens (Human))
BDBM50048246
PNG
(CHEMBL3310775)
Show SMILES CC(C)Oc1ccc(cc1)-c1nc(SCc2cccc(F)c2F)nc(O)c1C#N
Show InChI InChI=1S/C21H17F2N3O2S/c1-12(2)28-15-8-6-13(7-9-15)19-16(10-24)20(27)26-21(25-19)29-11-14-4-3-5-17(22)18(14)23/h3-9,12H,11H2,1-2H3,(H,25,26,27)
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n/an/a 1.60E+3n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Antagonist activity against human recombinant CXCR2 receptor expressed in CHO cell membranes by SPA based [35S]GTPgammaS binding assay


Bioorg Med Chem Lett 24: 3285-90 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.011
More data for this
Ligand-Target Pair
Interleukin-8 receptors, CXCR2


(Homo sapiens (Human))
BDBM50048254
PNG
(CHEMBL3310782)
Show SMILES Oc1nc(SCc2cccc(F)c2F)nc(C2CCC2)c1C#N
Show InChI InChI=1S/C16H13F2N3OS/c17-12-6-2-5-10(13(12)18)8-23-16-20-14(9-3-1-4-9)11(7-19)15(22)21-16/h2,5-6,9H,1,3-4,8H2,(H,20,21,22)
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n/an/a 1.70E+3n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Antagonist activity against human recombinant CXCR2 receptor expressed in CHO cell membranes by SPA based [35S]GTPgammaS binding assay


Bioorg Med Chem Lett 24: 3285-90 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.011
More data for this
Ligand-Target Pair
Interleukin-8 receptors, CXCR2


(Homo sapiens (Human))
BDBM50048226
PNG
(CHEMBL3311397)
Show SMILES Oc1nc(SCc2cccc(F)c2F)nc(C2CC2)c1I
Show InChI InChI=1S/C14H11F2IN2OS/c15-9-3-1-2-8(10(9)16)6-21-14-18-12(7-4-5-7)11(17)13(20)19-14/h1-3,7H,4-6H2,(H,18,19,20)
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n/an/a 3.20E+3n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Antagonist activity against human recombinant CXCR2 receptor expressed in CHO cell membranes by SPA based [35S]GTPgammaS binding assay


Bioorg Med Chem Lett 24: 3285-90 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.011
More data for this
Ligand-Target Pair
Interleukin-8 receptors, CXCR2


(Homo sapiens (Human))
BDBM50048255
PNG
(CHEMBL3310784)
Show SMILES CC(C)(C)c1nc(SCc2cccc(F)c2F)nc(O)c1C#N
Show InChI InChI=1S/C16H15F2N3OS/c1-16(2,3)13-10(7-19)14(22)21-15(20-13)23-8-9-5-4-6-11(17)12(9)18/h4-6H,8H2,1-3H3,(H,20,21,22)
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Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Antagonist activity against human recombinant CXCR2 receptor expressed in CHO cell membranes by SPA based [35S]GTPgammaS binding assay


Bioorg Med Chem Lett 24: 3285-90 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.011
More data for this
Ligand-Target Pair
Interleukin-8 receptors, CXCR2


(Homo sapiens (Human))
BDBM50048256
PNG
(CHEMBL3310769)
Show SMILES Oc1nc(SCc2cccc(F)c2F)nc(-c2ccccc2)c1C#N
Show InChI InChI=1S/C18H11F2N3OS/c19-14-8-4-7-12(15(14)20)10-25-18-22-16(11-5-2-1-3-6-11)13(9-21)17(24)23-18/h1-8H,10H2,(H,22,23,24)
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n/an/a 3.70E+3n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Antagonist activity against human recombinant CXCR2 receptor expressed in CHO cell membranes by SPA based [35S]GTPgammaS binding assay


Bioorg Med Chem Lett 24: 3285-90 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.011
More data for this
Ligand-Target Pair
Interleukin-8 receptors, CXCR2


(Homo sapiens (Human))
BDBM50048251
PNG
(CHEMBL3310779)
Show SMILES Cc1nc(SCc2cccc(F)c2F)nc(O)c1C#N
Show InChI InChI=1S/C13H9F2N3OS/c1-7-9(5-16)12(19)18-13(17-7)20-6-8-3-2-4-10(14)11(8)15/h2-4H,6H2,1H3,(H,17,18,19)
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n/an/a 4.30E+3n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Antagonist activity against human recombinant CXCR2 receptor expressed in CHO cell membranes by SPA based [35S]GTPgammaS binding assay


Bioorg Med Chem Lett 24: 3285-90 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.011
More data for this
Ligand-Target Pair
Interleukin-8 receptors, CXCR2


(Homo sapiens (Human))
BDBM50048227
PNG
(CHEMBL3310768)
Show SMILES Oc1nc(SCc2c(Cl)cccc2Cl)nc(-c2ccccc2)c1C#N
Show InChI InChI=1S/C18H11Cl2N3OS/c19-14-7-4-8-15(20)13(14)10-25-18-22-16(11-5-2-1-3-6-11)12(9-21)17(24)23-18/h1-8H,10H2,(H,22,23,24)
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n/an/a 4.30E+3n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Displacement of [125I]-GRO-alpha from human recombinant CXCR2 receptor expressed in CHO cell membranes


Bioorg Med Chem Lett 24: 3285-90 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.011
More data for this
Ligand-Target Pair
Interleukin-8 receptors, CXCR2


(Homo sapiens (Human))
BDBM50048247
PNG
(CHEMBL3310776)
Show SMILES COc1ccc(cc1C)-c1nc(SCc2cccc(F)c2F)nc(O)c1C#N
Show InChI InChI=1S/C20H15F2N3O2S/c1-11-8-12(6-7-16(11)27-2)18-14(9-23)19(26)25-20(24-18)28-10-13-4-3-5-15(21)17(13)22/h3-8H,10H2,1-2H3,(H,24,25,26)
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n/an/a 4.60E+3n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Antagonist activity against human recombinant CXCR2 receptor expressed in CHO cell membranes by SPA based [35S]GTPgammaS binding assay


Bioorg Med Chem Lett 24: 3285-90 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.011
More data for this
Ligand-Target Pair
Interleukin-8 receptors, CXCR2


(Homo sapiens (Human))
BDBM50048250
PNG
(CHEMBL3310778)
Show SMILES Cc1cccc(c1)-c1nc(SCc2cccc(F)c2F)nc(O)c1C#N
Show InChI InChI=1S/C19H13F2N3OS/c1-11-4-2-5-12(8-11)17-14(9-22)18(25)24-19(23-17)26-10-13-6-3-7-15(20)16(13)21/h2-8H,10H2,1H3,(H,23,24,25)
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n/an/a 4.70E+3n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Antagonist activity against human recombinant CXCR2 receptor expressed in CHO cell membranes by SPA based [35S]GTPgammaS binding assay


Bioorg Med Chem Lett 24: 3285-90 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.011
More data for this
Ligand-Target Pair
Interleukin-8 receptors, CXCR2


(Homo sapiens (Human))
BDBM50048185
PNG
(CHEMBL3310790)
Show SMILES CC(Sc1nc(O)c(C#N)c(n1)C1CC1)c1ccccc1
Show InChI InChI=1/C16H15N3OS/c1-10(11-5-3-2-4-6-11)21-16-18-14(12-7-8-12)13(9-17)15(20)19-16/h2-6,10,12H,7-8H2,1H3,(H,18,19,20)
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n/an/a 4.80E+3n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Antagonist activity against human recombinant CXCR2 receptor expressed in CHO cell membranes by SPA based [35S]GTPgammaS binding assay


Bioorg Med Chem Lett 24: 3285-90 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.011
More data for this
Ligand-Target Pair
Interleukin-8 receptors, CXCR2


(Homo sapiens (Human))
BDBM50048253
PNG
(CHEMBL3310781)
Show SMILES Oc1nc(SCc2cccc(F)c2F)nc(C2CCCC2)c1C#N
Show InChI InChI=1S/C17H15F2N3OS/c18-13-7-3-6-11(14(13)19)9-24-17-21-15(10-4-1-2-5-10)12(8-20)16(23)22-17/h3,6-7,10H,1-2,4-5,9H2,(H,21,22,23)
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n/an/a 4.90E+3n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Antagonist activity against human recombinant CXCR2 receptor expressed in CHO cell membranes by SPA based [35S]GTPgammaS binding assay


Bioorg Med Chem Lett 24: 3285-90 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.011
More data for this
Ligand-Target Pair
Interleukin-8 receptors, CXCR2


(Homo sapiens (Human))
BDBM50048186
PNG
(CHEMBL3310791)
Show SMILES CC(C)(Sc1nc(O)c(C#N)c(n1)C1CC1)c1ccccc1
Show InChI InChI=1S/C17H17N3OS/c1-17(2,12-6-4-3-5-7-12)22-16-19-14(11-8-9-11)13(10-18)15(21)20-16/h3-7,11H,8-9H2,1-2H3,(H,19,20,21)
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n/an/a 6.40E+3n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Antagonist activity against human recombinant CXCR2 receptor expressed in CHO cell membranes by SPA based [35S]GTPgammaS binding assay


Bioorg Med Chem Lett 24: 3285-90 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.011
More data for this
Ligand-Target Pair
Interleukin-8 receptors, CXCR2


(Homo sapiens (Human))
BDBM50048231
PNG
(CHEMBL3310772)
Show SMILES Oc1nc(SCc2cccc(F)c2F)nc(-c2ccc(Cl)cc2)c1C#N
Show InChI InChI=1S/C18H10ClF2N3OS/c19-12-6-4-10(5-7-12)16-13(8-22)17(25)24-18(23-16)26-9-11-2-1-3-14(20)15(11)21/h1-7H,9H2,(H,23,24,25)
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n/an/a 7.40E+3n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Antagonist activity against human recombinant CXCR2 receptor expressed in CHO cell membranes by SPA based [35S]GTPgammaS binding assay


Bioorg Med Chem Lett 24: 3285-90 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.011
More data for this
Ligand-Target Pair
Interleukin-8 receptors, CXCR2


(Homo sapiens (Human))
BDBM50048188
PNG
(CHEMBL3310793)
Show SMILES Oc1nc(CSc2cccc(F)c2F)nc(C2CC2)c1C#N
Show InChI InChI=1S/C15H11F2N3OS/c16-10-2-1-3-11(13(10)17)22-7-12-19-14(8-4-5-8)9(6-18)15(21)20-12/h1-3,8H,4-5,7H2,(H,19,20,21)
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n/an/a 1.00E+4n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Antagonist activity against human recombinant CXCR2 receptor expressed in CHO cell membranes by SPA based [35S]GTPgammaS binding assay


Bioorg Med Chem Lett 24: 3285-90 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.011
More data for this
Ligand-Target Pair
Interleukin-8 receptors, CXCR2


(Homo sapiens (Human))
BDBM50048257
PNG
(CHEMBL3310770)
Show SMILES CS(=O)(=O)Nc1nc(SCc2cccc(F)c2F)nc(-c2ccccc2)c1C#N
Show InChI InChI=1S/C19H14F2N4O2S2/c1-29(26,27)25-18-14(10-22)17(12-6-3-2-4-7-12)23-19(24-18)28-11-13-8-5-9-15(20)16(13)21/h2-9H,11H2,1H3,(H,23,24,25)
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n/an/a>3.00E+4n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Antagonist activity against human recombinant CXCR2 receptor expressed in CHO cell membranes by SPA based [35S]GTPgammaS binding assay


Bioorg Med Chem Lett 24: 3285-90 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.011
More data for this
Ligand-Target Pair
Interleukin-8 receptors, CXCR2


(Homo sapiens (Human))
BDBM50048187
PNG
(CHEMBL3310792)
Show SMILES Oc1nc(CSc2ccccc2)nc(C2CC2)c1C#N
Show InChI InChI=1S/C15H13N3OS/c16-8-12-14(10-6-7-10)17-13(18-15(12)19)9-20-11-4-2-1-3-5-11/h1-5,10H,6-7,9H2,(H,17,18,19)
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n/an/a>3.00E+4n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Antagonist activity against human recombinant CXCR2 receptor expressed in CHO cell membranes by SPA based [35S]GTPgammaS binding assay


Bioorg Med Chem Lett 24: 3285-90 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.011
More data for this
Ligand-Target Pair
Interleukin-8 receptors, CXCR2


(Homo sapiens (Human))
BDBM50048229
PNG
(CHEMBL3310771)
Show SMILES CC(C)(CO)Nc1nc(SCc2cccc(F)c2F)nc(-c2ccccc2)c1C#N
Show InChI InChI=1S/C22H20F2N4OS/c1-22(2,13-29)28-20-16(11-25)19(14-7-4-3-5-8-14)26-21(27-20)30-12-15-9-6-10-17(23)18(15)24/h3-10,29H,12-13H2,1-2H3,(H,26,27,28)
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n/an/a>3.00E+4n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Antagonist activity against human recombinant CXCR2 receptor expressed in CHO cell membranes by SPA based [35S]GTPgammaS binding assay


Bioorg Med Chem Lett 24: 3285-90 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.011
More data for this
Ligand-Target Pair
Interleukin-8 receptors, CXCR2


(Homo sapiens (Human))
BDBM50048227
PNG
(CHEMBL3310768)
Show SMILES Oc1nc(SCc2c(Cl)cccc2Cl)nc(-c2ccccc2)c1C#N
Show InChI InChI=1S/C18H11Cl2N3OS/c19-14-7-4-8-15(20)13(14)10-25-18-22-16(11-5-2-1-3-6-11)12(9-21)17(24)23-18/h1-8H,10H2,(H,22,23,24)
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n/an/a>3.00E+4n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Antagonist activity against human recombinant CXCR2 receptor expressed in CHO cell membranes by SPA based [35S]GTPgammaS binding assay


Bioorg Med Chem Lett 24: 3285-90 (2014)


Article DOI: 10.1016/j.bmcl.2014.06.011
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%