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Compile Data Set for Download or QSAR

Found 31 hits of ic50 for UniProtKB: P25025   
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
C-X-C chemokine receptor type 1/2


(Homo sapiens (Human))		BDBM50475205
PNG
(CHEMBL190899)
Show SMILES CONC(=O)[C@H](C)c1ccc(CC(C)C)cc1
Show InChI InChI=1S/C14H21NO2/c1-10(2)9-12-5-7-13(8-6-12)11(3)14(16)15-17-4/h5-8,10-11H,9H2,1-4H3,(H,15,16)/t11-/m1/s1
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n/an/a 1.80n/an/an/an/an/an/a



Domp£ S.p.A.

Curated by ChEMBL


Assay Description
Inhibition of CXCL8-induced chemotaxis in human polymorphonuclear cells

J Med Chem 48: 4312-31 (2005)


Article DOI: 10.1021/jm049082i
BindingDB Entry DOI: 10.7270/Q2Z89G5H
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1/2


(Homo sapiens (Human))		BDBM50169045
PNG
((R)-2-(4-isobutylphenyl)-N-(methylsulfonyl)propana...)
Show SMILES CC(C)Cc1ccc(cc1)[C@@H](C)C(=O)NS(C)(=O)=O
Show InChI InChI=1S/C14H21NO3S/c1-10(2)9-12-5-7-13(8-6-12)11(3)14(16)15-19(4,17)18/h5-8,10-11H,9H2,1-4H3,(H,15,16)/t11-/m1/s1
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n/an/a 5.30n/an/an/an/an/an/a



Domp£ S.p.A.

Curated by ChEMBL


Assay Description
Inhibition of CXCL8-induced chemotaxis in human polymorphonuclear cells

J Med Chem 48: 4312-31 (2005)


Article DOI: 10.1021/jm049082i
BindingDB Entry DOI: 10.7270/Q2Z89G5H
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1/2


(Homo sapiens (Human))		BDBM50169048
PNG
((R)-2-(3-Benzoyl-phenyl)-propionic acid | (R)-2-(3...)
Show SMILES C[C@@H](C(O)=O)c1cccc(c1)C(=O)c1ccccc1
Show InChI InChI=1S/C16H14O3/c1-11(16(18)19)13-8-5-9-14(10-13)15(17)12-6-3-2-4-7-12/h2-11H,1H3,(H,18,19)/t11-/m1/s1
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n/an/a 34n/an/an/an/an/an/a



Domp£ S.p.A.

Curated by ChEMBL


Assay Description
Inhibition of CXCL8-induced chemotaxis in human polymorphonuclear cells

J Med Chem 48: 4312-31 (2005)


Article DOI: 10.1021/jm049082i
BindingDB Entry DOI: 10.7270/Q2Z89G5H
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1/2


(Homo sapiens (Human))		BDBM50113628
PNG
(CHEMBL431511 | [5-(4-Fluoro-phenylcarbamoyl)-pyrid...)
Show SMILES COC(=O)CSc1ccc(cn1)C(=O)Nc1ccc(F)cc1
Show InChI InChI=1S/C15H13FN2O3S/c1-21-14(19)9-22-13-7-2-10(8-17-13)15(20)18-12-5-3-11(16)4-6-12/h2-8H,9H2,1H3,(H,18,20)
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n/an/a 42n/an/an/an/an/an/a



Celltech R&D Inc.

Curated by ChEMBL


Assay Description
Inhibition against GRO-alpha driven human neutrophil chemotaxis

Bioorg Med Chem Lett 12: 1517-20 (2002)


BindingDB Entry DOI: 10.7270/Q2JM28ZD
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1/2


(Homo sapiens (Human))		BDBM50219799
PNG
(CHEMBL36535)
Show SMILES Fc1ccc(NC(=O)c2ccc(SCC(=O)OCc3cccc(F)c3)nc2)cc1
Show InChI InChI=1S/C21H16F2N2O3S/c22-16-5-7-18(8-6-16)25-21(27)15-4-9-19(24-11-15)29-13-20(26)28-12-14-2-1-3-17(23)10-14/h1-11H,12-13H2,(H,25,27)
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Celltech R&D Inc.

Curated by ChEMBL


Assay Description
Inhibition against GRO-alpha driven human neutrophil chemotaxis

Bioorg Med Chem Lett 12: 1517-20 (2002)


BindingDB Entry DOI: 10.7270/Q2JM28ZD
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1/2


(Homo sapiens (Human))		BDBM50219797
PNG
(CHEMBL36934)
Show SMILES CCCOC(=O)CSc1ccc(cn1)C(=O)Nc1ccc(F)cc1
Show InChI InChI=1S/C17H17FN2O3S/c1-2-9-23-16(21)11-24-15-8-3-12(10-19-15)17(22)20-14-6-4-13(18)5-7-14/h3-8,10H,2,9,11H2,1H3,(H,20,22)
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n/an/a 46n/an/an/an/an/an/a



Celltech R&D Inc.

Curated by ChEMBL


Assay Description
Inhibition against GRO-alpha driven human neutrophil chemotaxis

Bioorg Med Chem Lett 12: 1517-20 (2002)


BindingDB Entry DOI: 10.7270/Q2JM28ZD
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1/2


(Homo sapiens (Human))		BDBM50088570
PNG
((S)-2-(3-Benzoyl-phenyl)-propionic acid | (S)-2-(3...)
Show SMILES C[C@H](C(O)=O)c1cccc(c1)C(=O)c1ccccc1
Show InChI InChI=1S/C16H14O3/c1-11(16(18)19)13-8-5-9-14(10-13)15(17)12-6-3-2-4-7-12/h2-11H,1H3,(H,18,19)/t11-/m0/s1
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n/an/a 50n/an/an/an/an/an/a



Domp£ S.p.A.

Curated by ChEMBL


Assay Description
Inhibition of CXCL8-induced chemotaxis in human polymorphonuclear cells

J Med Chem 48: 4312-31 (2005)


Article DOI: 10.1021/jm049082i
BindingDB Entry DOI: 10.7270/Q2Z89G5H
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1/2


(Homo sapiens (Human))		BDBM50219796
PNG
(CHEMBL39464)
Show SMILES Fc1ccc(NC(=O)c2ccc(OCC(=O)OCc3cccc(F)c3)nc2)cc1
Show InChI InChI=1S/C21H16F2N2O4/c22-16-5-7-18(8-6-16)25-21(27)15-4-9-19(24-11-15)28-13-20(26)29-12-14-2-1-3-17(23)10-14/h1-11H,12-13H2,(H,25,27)
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n/an/a 50n/an/an/an/an/an/a



Celltech R&D Inc.

Curated by ChEMBL


Assay Description
Inhibition against GRO-alpha driven human neutrophil chemotaxis

Bioorg Med Chem Lett 12: 1517-20 (2002)


BindingDB Entry DOI: 10.7270/Q2JM28ZD
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1/2


(Homo sapiens (Human))		BDBM50475204
PNG
(CHEMBL192943)
Show SMILES CC(C)Cc1ccc(cc1)[C@H](C)C(=O)NS(C)(=O)=O
Show InChI InChI=1S/C14H21NO3S/c1-10(2)9-12-5-7-13(8-6-12)11(3)14(16)15-19(4,17)18/h5-8,10-11H,9H2,1-4H3,(H,15,16)/t11-/m0/s1
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n/an/a 80n/an/an/an/an/an/a



Domp£ S.p.A.

Curated by ChEMBL


Assay Description
Inhibition of CXCL8-induced chemotaxis in human polymorphonuclear cells

J Med Chem 48: 4312-31 (2005)


Article DOI: 10.1021/jm049082i
BindingDB Entry DOI: 10.7270/Q2Z89G5H
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1/2


(Homo sapiens (Human))		BDBM50219800
PNG
(CHEMBL432475)
Show SMILES Fc1ccc(NC(=O)c2ccc(SCC(=O)OCc3ccc(Br)cc3)nc2)cc1
Show InChI InChI=1S/C21H16BrFN2O3S/c22-16-4-1-14(2-5-16)12-28-20(26)13-29-19-10-3-15(11-24-19)21(27)25-18-8-6-17(23)7-9-18/h1-11H,12-13H2,(H,25,27)
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n/an/a 83n/an/an/an/an/an/a



Celltech R&D Inc.

Curated by ChEMBL


Assay Description
Inhibition against GRO-alpha driven human neutrophil chemotaxis

Bioorg Med Chem Lett 12: 1517-20 (2002)


BindingDB Entry DOI: 10.7270/Q2JM28ZD
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1/2


(Homo sapiens (Human))		BDBM50219806
PNG
(CHEMBL291140)
Show SMILES Fc1ccc(NC(=O)c2ccc(OCC(=O)OCc3ccccc3)nc2)cc1
Show InChI InChI=1S/C21H17FN2O4/c22-17-7-9-18(10-8-17)24-21(26)16-6-11-19(23-12-16)27-14-20(25)28-13-15-4-2-1-3-5-15/h1-12H,13-14H2,(H,24,26)
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n/an/a 94n/an/an/an/an/an/a



Celltech R&D Inc.

Curated by ChEMBL


Assay Description
Inhibition against GRO-alpha driven human neutrophil chemotaxis

Bioorg Med Chem Lett 12: 1517-20 (2002)


BindingDB Entry DOI: 10.7270/Q2JM28ZD
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1/2


(Homo sapiens (Human))		BDBM50169047
PNG
((S)-2-(4-Isobutyl-phenyl)-propionic acid | (S)-2-(...)
Show SMILES CC(C)Cc1ccc(cc1)[C@H](C)C(O)=O |r|
Show InChI InChI=1S/C13H18O2/c1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)15/h4-7,9-10H,8H2,1-3H3,(H,14,15)/t10-/m0/s1
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n/an/a 100n/an/an/an/an/an/a



Domp£ S.p.A.

Curated by ChEMBL


Assay Description
Inhibition of CXCL8-induced chemotaxis in human polymorphonuclear cells

J Med Chem 48: 4312-31 (2005)


Article DOI: 10.1021/jm049082i
BindingDB Entry DOI: 10.7270/Q2Z89G5H
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1/2


(Homo sapiens (Human))		BDBM50219809
PNG
(CHEMBL36643)
Show SMILES COC(=O)COc1ccc(cn1)C(=O)Nc1ccc(F)cc1
Show InChI InChI=1S/C15H13FN2O4/c1-21-14(19)9-22-13-7-2-10(8-17-13)15(20)18-12-5-3-11(16)4-6-12/h2-8H,9H2,1H3,(H,18,20)
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n/an/a 110n/an/an/an/an/an/a



Celltech R&D Inc.

Curated by ChEMBL


Assay Description
Inhibition against GRO-alpha driven human neutrophil chemotaxis

Bioorg Med Chem Lett 12: 1517-20 (2002)


BindingDB Entry DOI: 10.7270/Q2JM28ZD
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1/2


(Homo sapiens (Human))		BDBM50169044
PNG
((-)-ibuprofen | (2R)-2-(4-isobutylphenyl)propanoic...)
Show SMILES CC(C)Cc1ccc(cc1)[C@@H](C)C(O)=O
Show InChI InChI=1S/C13H18O2/c1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)15/h4-7,9-10H,8H2,1-3H3,(H,14,15)/t10-/m1/s1
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n/an/a 110n/an/an/an/an/an/a



Domp£ S.p.A.

Curated by ChEMBL


Assay Description
Inhibition of CXCL8-induced chemotaxis in human polymorphonuclear cells

J Med Chem 48: 4312-31 (2005)


Article DOI: 10.1021/jm049082i
BindingDB Entry DOI: 10.7270/Q2Z89G5H
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1/2


(Homo sapiens (Human))		BDBM50219811
PNG
(CHEMBL39710)
Show SMILES CCOC(=O)COc1ccc(cn1)C(=O)Nc1ccc(F)cc1
Show InChI InChI=1S/C16H15FN2O4/c1-2-22-15(20)10-23-14-8-3-11(9-18-14)16(21)19-13-6-4-12(17)5-7-13/h3-9H,2,10H2,1H3,(H,19,21)
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n/an/a 160n/an/an/an/an/an/a



Celltech R&D Inc.

Curated by ChEMBL


Assay Description
Inhibition against GRO-alpha driven human neutrophil chemotaxis

Bioorg Med Chem Lett 12: 1517-20 (2002)


BindingDB Entry DOI: 10.7270/Q2JM28ZD
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1/2


(Homo sapiens (Human))		BDBM50219812
PNG
(CHEMBL36842)
Show SMILES CC(C)CCOC(=O)COc1ccc(cn1)C(=O)Nc1ccc(F)cc1
Show InChI InChI=1S/C19H21FN2O4/c1-13(2)9-10-25-18(23)12-26-17-8-3-14(11-21-17)19(24)22-16-6-4-15(20)5-7-16/h3-8,11,13H,9-10,12H2,1-2H3,(H,22,24)
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Celltech R&D Inc.

Curated by ChEMBL


Assay Description
Inhibition against GRO-alpha driven human neutrophil chemotaxis

Bioorg Med Chem Lett 12: 1517-20 (2002)


BindingDB Entry DOI: 10.7270/Q2JM28ZD
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1/2


(Homo sapiens (Human))		BDBM50219794
PNG
(CHEMBL289656)
Show SMILES Fc1ccc(NC(=O)c2ccc(OCC(=O)OC3CCCCC3)nc2)cc1
Show InChI InChI=1S/C20H21FN2O4/c21-15-7-9-16(10-8-15)23-20(25)14-6-11-18(22-12-14)26-13-19(24)27-17-4-2-1-3-5-17/h6-12,17H,1-5,13H2,(H,23,25)
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n/an/a 220n/an/an/an/an/an/a



Celltech R&D Inc.

Curated by ChEMBL


Assay Description
Inhibition against GRO-alpha driven human neutrophil chemotaxis

Bioorg Med Chem Lett 12: 1517-20 (2002)


BindingDB Entry DOI: 10.7270/Q2JM28ZD
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1/2


(Homo sapiens (Human))		BDBM50219808
PNG
(CHEMBL288527)
Show SMILES Fc1ccc(NC(=O)c2ccc(OCC(=O)Nc3cccnc3)nc2)cc1
Show InChI InChI=1S/C19H15FN4O3/c20-14-4-6-15(7-5-14)24-19(26)13-3-8-18(22-10-13)27-12-17(25)23-16-2-1-9-21-11-16/h1-11H,12H2,(H,23,25)(H,24,26)
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Celltech R&D Inc.

Curated by ChEMBL


Assay Description
Inhibition against GRO-alpha driven human neutrophil chemotaxis

Bioorg Med Chem Lett 12: 1517-20 (2002)


BindingDB Entry DOI: 10.7270/Q2JM28ZD
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1/2


(Homo sapiens (Human))		BDBM50219810
PNG
(CHEMBL288876)
Show SMILES COC(=O)COc1ccc(NC(=O)c2ccc(F)cc2)cn1
Show InChI InChI=1S/C15H13FN2O4/c1-21-14(19)9-22-13-7-6-12(8-17-13)18-15(20)10-2-4-11(16)5-3-10/h2-8H,9H2,1H3,(H,18,20)
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n/an/a 360n/an/an/an/an/an/a



Celltech R&D Inc.

Curated by ChEMBL


Assay Description
Inhibition against GRO-alpha driven human neutrophil chemotaxis

Bioorg Med Chem Lett 12: 1517-20 (2002)


BindingDB Entry DOI: 10.7270/Q2JM28ZD
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1/2


(Homo sapiens (Human))		BDBM50219795
PNG
(CHEMBL40080)
Show SMILES Fc1ccc(NC(=O)c2ccc(OCC(=O)Oc3ccccc3)nc2)cc1
Show InChI InChI=1S/C20H15FN2O4/c21-15-7-9-16(10-8-15)23-20(25)14-6-11-18(22-12-14)26-13-19(24)27-17-4-2-1-3-5-17/h1-12H,13H2,(H,23,25)
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Celltech R&D Inc.

Curated by ChEMBL


Assay Description
Inhibition against GRO-alpha driven human neutrophil chemotaxis

Bioorg Med Chem Lett 12: 1517-20 (2002)


BindingDB Entry DOI: 10.7270/Q2JM28ZD
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1/2


(Homo sapiens (Human))		BDBM50219789
PNG
(CHEMBL40955)
Show SMILES Fc1ccc(NC(=O)c2ccc(OCC(=O)OCCCCC3CCCCC3)nc2)cc1
Show InChI InChI=1S/C24H29FN2O4/c25-20-10-12-21(13-11-20)27-24(29)19-9-14-22(26-16-19)31-17-23(28)30-15-5-4-8-18-6-2-1-3-7-18/h9-14,16,18H,1-8,15,17H2,(H,27,29)
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Celltech R&D Inc.

Curated by ChEMBL


Assay Description
Inhibition against GRO-alpha driven human neutrophil chemotaxis

Bioorg Med Chem Lett 12: 1517-20 (2002)


BindingDB Entry DOI: 10.7270/Q2JM28ZD
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1/2


(Homo sapiens (Human))		BDBM50219793
PNG
(CHEMBL289789)
Show SMILES COC(=O)CCSc1ccc(cn1)C(=O)Nc1ccc(F)cc1
Show InChI InChI=1S/C16H15FN2O3S/c1-22-15(20)8-9-23-14-7-2-11(10-18-14)16(21)19-13-5-3-12(17)4-6-13/h2-7,10H,8-9H2,1H3,(H,19,21)
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Celltech R&D Inc.

Curated by ChEMBL


Assay Description
Inhibition against GRO-alpha driven human neutrophil chemotaxis

Bioorg Med Chem Lett 12: 1517-20 (2002)


BindingDB Entry DOI: 10.7270/Q2JM28ZD
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1/2


(Homo sapiens (Human))		BDBM50219790
PNG
(CHEMBL39937)
Show SMILES Fc1ccc(NC(=O)c2ccc(OCC(=O)Nc3ccccc3)nc2)cc1
Show InChI InChI=1S/C20H16FN3O3/c21-15-7-9-17(10-8-15)24-20(26)14-6-11-19(22-12-14)27-13-18(25)23-16-4-2-1-3-5-16/h1-12H,13H2,(H,23,25)(H,24,26)
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n/an/a 1.00E+3n/an/an/an/an/an/a



Celltech R&D Inc.

Curated by ChEMBL


Assay Description
Inhibition against GRO-alpha driven human neutrophil chemotaxis

Bioorg Med Chem Lett 12: 1517-20 (2002)


BindingDB Entry DOI: 10.7270/Q2JM28ZD
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1/2


(Homo sapiens (Human))		BDBM50219801
PNG
(CHEMBL40558)
Show SMILES Fc1ccc(NC(=O)c2ccc(OCC(=O)Nc3cccc(Br)c3)nc2)cc1
Show InChI InChI=1S/C20H15BrFN3O3/c21-14-2-1-3-17(10-14)24-18(26)12-28-19-9-4-13(11-23-19)20(27)25-16-7-5-15(22)6-8-16/h1-11H,12H2,(H,24,26)(H,25,27)
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n/an/a 2.70E+3n/an/an/an/an/an/a



Celltech R&D Inc.

Curated by ChEMBL


Assay Description
Inhibition against GRO-alpha driven human neutrophil chemotaxis

Bioorg Med Chem Lett 12: 1517-20 (2002)


BindingDB Entry DOI: 10.7270/Q2JM28ZD
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1/2


(Homo sapiens (Human))		BDBM50219798
PNG
(CHEMBL39988)
Show SMILES OC(=O)CCCSc1ccc(cn1)C(=O)Nc1ccc(F)cc1
Show InChI InChI=1S/C16H15FN2O3S/c17-12-4-6-13(7-5-12)19-16(22)11-3-8-14(18-10-11)23-9-1-2-15(20)21/h3-8,10H,1-2,9H2,(H,19,22)(H,20,21)
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n/an/a 5.10E+3n/an/an/an/an/an/a



Celltech R&D Inc.

Curated by ChEMBL


Assay Description
Inhibition against GRO-alpha driven human neutrophil chemotaxis

Bioorg Med Chem Lett 12: 1517-20 (2002)


BindingDB Entry DOI: 10.7270/Q2JM28ZD
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1/2


(Homo sapiens (Human))		BDBM50219792
PNG
(CHEMBL40114)
Show SMILES CN(C(=O)COc1ccc(cn1)C(=O)Nc1ccc(F)cc1)c1ccccc1
Show InChI InChI=1S/C21H18FN3O3/c1-25(18-5-3-2-4-6-18)20(26)14-28-19-12-7-15(13-23-19)21(27)24-17-10-8-16(22)9-11-17/h2-13H,14H2,1H3,(H,24,27)
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n/an/a 1.25E+4n/an/an/an/an/an/a



Celltech R&D Inc.

Curated by ChEMBL


Assay Description
Inhibition against GRO-alpha driven human neutrophil chemotaxis

Bioorg Med Chem Lett 12: 1517-20 (2002)


BindingDB Entry DOI: 10.7270/Q2JM28ZD
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1/2


(Homo sapiens (Human))		BDBM50213962
PNG
(CHEMBL410765)
Show SMILES CSCC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H]([C@@H](C)O)C(=O)NCC(=O)N[C@@H](CCSC)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(N)=O
Show InChI InChI=1S/C112H150N24O38S2/c1-55(2)41-69(122-103(165)77(49-89(149)150)131-106(168)79(51-91(153)154)129-98(160)70(42-59-19-10-8-11-20-59)123-105(167)78(50-90(151)152)130-100(162)73(45-62-52-115-65-24-15-14-23-64(62)65)126-96(158)67(34-39-175-6)118-58(5)139)97(159)127-74(46-84(113)141)101(163)125-72(43-60-21-12-9-13-22-60)107(169)133-92(57(4)138)109(171)116-53-85(142)119-68(35-40-176-7)110(172)136-38-18-27-83(136)112(174)135-37-17-26-82(135)108(170)117-56(3)94(156)121-75(47-87(145)146)102(164)120-66(32-33-86(143)144)95(157)128-76(48-88(147)148)104(166)124-71(44-61-28-30-63(140)31-29-61)99(161)132-80(54-137)111(173)134-36-16-25-81(134)93(114)155/h8-15,19-24,28-31,52,55-57,66-83,92,115,137-138,140H,16-18,25-27,32-51,53-54H2,1-7H3,(H2,113,141)(H2,114,155)(H,116,171)(H,117,170)(H,118,139)(H,119,142)(H,120,164)(H,121,156)(H,122,165)(H,123,167)(H,124,166)(H,125,163)(H,126,158)(H,127,159)(H,128,157)(H,129,160)(H,130,162)(H,131,168)(H,132,161)(H,133,169)(H,143,144)(H,145,146)(H,147,148)(H,149,150)(H,151,152)(H,153,154)/t56-,57+,66-,67-,68-,69-,70-,71-,72-,73-,74-,75-,76-,77-,78-,79-,80-,81-,82-,83-,92-/m0/s1
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n/an/a 1.90E+4n/an/an/an/an/an/a


TBA

Assay Description
Compound was tested for inhibitory activity against Interleukin-8 receptor

Citation and Details

BindingDB Entry DOI: 10.7270/Q2P55QP3
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1/2


(Homo sapiens (Human))		BDBM50219788
PNG
(CHEMBL36797)
Show SMILES CNC(=O)COc1ccc(cn1)C(=O)Nc1ccc(F)cc1
Show InChI InChI=1S/C15H14FN3O3/c1-17-13(20)9-22-14-7-2-10(8-18-14)15(21)19-12-5-3-11(16)4-6-12/h2-8H,9H2,1H3,(H,17,20)(H,19,21)
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n/an/a>2.00E+4n/an/an/an/an/an/a



Celltech R&D Inc.

Curated by ChEMBL


Assay Description
Inhibition against GRO-alpha driven human neutrophil chemotaxis

Bioorg Med Chem Lett 12: 1517-20 (2002)


BindingDB Entry DOI: 10.7270/Q2JM28ZD
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1/2


(Homo sapiens (Human))		BDBM50219791
PNG
(CHEMBL35938)
Show SMILES Fc1ccc(NC(=O)c2ccc(OCC(=O)NC3CCCC3)nc2)cc1
Show InChI InChI=1S/C19H20FN3O3/c20-14-6-8-16(9-7-14)23-19(25)13-5-10-18(21-11-13)26-12-17(24)22-15-3-1-2-4-15/h5-11,15H,1-4,12H2,(H,22,24)(H,23,25)
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n/an/a>2.00E+4n/an/an/an/an/an/a



Celltech R&D Inc.

Curated by ChEMBL


Assay Description
Inhibition against GRO-alpha driven human neutrophil chemotaxis

Bioorg Med Chem Lett 12: 1517-20 (2002)


BindingDB Entry DOI: 10.7270/Q2JM28ZD
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1/2


(Homo sapiens (Human))		BDBM50219807
PNG
(CHEMBL288457)
Show SMILES OC(=O)CCSc1ccc(cn1)C(=O)Nc1ccc(F)cc1
Show InChI InChI=1S/C15H13FN2O3S/c16-11-2-4-12(5-3-11)18-15(21)10-1-6-13(17-9-10)22-8-7-14(19)20/h1-6,9H,7-8H2,(H,18,21)(H,19,20)
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n/an/a>2.00E+4n/an/an/an/an/an/a



Celltech R&D Inc.

Curated by ChEMBL


Assay Description
Inhibition against GRO-alpha driven human neutrophil chemotaxis

Bioorg Med Chem Lett 12: 1517-20 (2002)


BindingDB Entry DOI: 10.7270/Q2JM28ZD
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1/2


(Homo sapiens (Human))		BDBM50113636
PNG
(CHEMBL39835 | [5-(4-Fluoro-phenylcarbamoyl)-pyridi...)
Show SMILES OC(=O)CSc1ccc(cn1)C(=O)Nc1ccc(F)cc1
Show InChI InChI=1S/C14H11FN2O3S/c15-10-2-4-11(5-3-10)17-14(20)9-1-6-12(16-7-9)21-8-13(18)19/h1-7H,8H2,(H,17,20)(H,18,19)
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n/an/a>2.00E+4n/an/an/an/an/an/a



Celltech R&D Inc.

Curated by ChEMBL


Assay Description
Inhibition against GRO-alpha driven human neutrophil chemotaxis

Bioorg Med Chem Lett 12: 1517-20 (2002)


BindingDB Entry DOI: 10.7270/Q2JM28ZD
More data for this
Ligand-Target Pair