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Patent code US9090596

Compile Data Set for Download or QSAR
Found 84 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
C-C chemokine receptor type 6


(Homo sapiens (Human))		BDBM172369
PNG
(US9090596, 50)
Show SMILES CN(C)C(=O)c1cccc(Nc2c(N[C@@H](c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O |r|
Show InChI InChI=1S/C23H25N3O6/c1-12-8-9-15(32-12)21(23(2)10-31-11-23)25-17-16(19(28)20(17)29)24-14-7-5-6-13(18(14)27)22(30)26(3)4/h5-9,21,24-25,27H,10-11H2,1-4H3/t21-/m0/s1
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n/an/a 1.40n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The experiments were carried out on the FLIPR TETRA.RTM. platform from Molecular Devices. After the basal level had been read, the compounds were add...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-C chemokine receptor type 6


(Homo sapiens (Human))		BDBM172372
PNG
(US9090596, 53)
Show SMILES CN1CCN(CC1)S(=O)(=O)c1c(Cl)ccc(Nc2c(N[C@@H](c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O |r|
Show InChI InChI=1S/C25H29ClN4O7S/c1-14-4-7-17(37-14)24(25(2)12-36-13-25)28-19-18(21(32)22(19)33)27-16-6-5-15(26)23(20(16)31)38(34,35)30-10-8-29(3)9-11-30/h4-7,24,27-28,31H,8-13H2,1-3H3/t24-/m0/s1
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n/an/a 1.90n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The experiments were carried out on the FLIPR TETRA.RTM. platform from Molecular Devices. After the basal level had been read, the compounds were add...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-C chemokine receptor type 6


(Homo sapiens (Human))		BDBM172342
PNG
(US9090596, 22)
Show SMILES CN(C)S(=O)(=O)c1c(Cl)ccc(Nc2c(NC(c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O
Show InChI InChI=1S/C22H24ClN3O7S/c1-11-5-8-14(33-11)21(22(2)9-32-10-22)25-16-15(18(28)19(16)29)24-13-7-6-12(23)20(17(13)27)34(30,31)26(3)4/h5-8,21,24-25,27H,9-10H2,1-4H3
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n/an/a 3.40n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The experiments were carried out on the FLIPR TETRA.RTM. platform from Molecular Devices. After the basal level had been read, the compounds were add...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-C chemokine receptor type 6


(Homo sapiens (Human))		BDBM172328
PNG
(US9090596, 8)
Show SMILES COC(=O)[C@H]1CCCN1C(=O)c1cccc(Nc2c(N[C@@H](c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O |r|
Show InChI InChI=1S/C27H29N3O8/c1-14-9-10-18(38-14)24(27(2)12-37-13-27)29-20-19(22(32)23(20)33)28-16-7-4-6-15(21(16)31)25(34)30-11-5-8-17(30)26(35)36-3/h4,6-7,9-10,17,24,28-29,31H,5,8,11-13H2,1-3H3/t17-,24+/m1/s1
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n/an/a 5.80n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The experiments were carried out on the FLIPR TETRA.RTM. platform from Molecular Devices. After the basal level had been read, the compounds were add...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 2


(Homo sapiens (Human))		BDBM172358
PNG
(US9090596, 38)
Show SMILES CC(C)c1coc(c1)C(Nc1c(Nc2cccc(C(=O)N(C)C)c2O)c(=O)c1=O)C1(C)COC1
Show InChI InChI=1S/C25H29N3O6/c1-13(2)14-9-17(34-10-14)23(25(3)11-33-12-25)27-19-18(21(30)22(19)31)26-16-8-6-7-15(20(16)29)24(32)28(4)5/h6-10,13,23,26-27,29H,11-12H2,1-5H3
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n/an/a 25n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 2


(Homo sapiens (Human))		BDBM172368
PNG
(US9090596, 48)
Show SMILES CN(CC(F)(F)F)C(=O)c1cccc(Nc2c(N[C@@H](c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O |r|
Show InChI InChI=1S/C24H24F3N3O6/c1-12-7-8-15(36-12)21(23(2)10-35-11-23)29-17-16(19(32)20(17)33)28-14-6-4-5-13(18(14)31)22(34)30(3)9-24(25,26)27/h4-8,21,28-29,31H,9-11H2,1-3H3/t21-/m0/s1
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n/an/a 26n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 2


(Homo sapiens (Human))		BDBM172372
PNG
(US9090596, 53)
Show SMILES CN1CCN(CC1)S(=O)(=O)c1c(Cl)ccc(Nc2c(N[C@@H](c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O |r|
Show InChI InChI=1S/C25H29ClN4O7S/c1-14-4-7-17(37-14)24(25(2)12-36-13-25)28-19-18(21(32)22(19)33)27-16-6-5-15(26)23(20(16)31)38(34,35)30-10-8-29(3)9-11-30/h4-7,24,27-28,31H,8-13H2,1-3H3/t24-/m0/s1
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n/an/a 30n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 2


(Homo sapiens (Human))		BDBM172342
PNG
(US9090596, 22)
Show SMILES CN(C)S(=O)(=O)c1c(Cl)ccc(Nc2c(NC(c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O
Show InChI InChI=1S/C22H24ClN3O7S/c1-11-5-8-14(33-11)21(22(2)9-32-10-22)25-16-15(18(28)19(16)29)24-13-7-6-12(23)20(17(13)27)34(30,31)26(3)4/h5-8,21,24-25,27H,9-10H2,1-4H3
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n/an/a 31n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 2


(Homo sapiens (Human))		BDBM172357
PNG
(US9090596, 37a | US9090596, 37b)
Show SMILES CN(C)C(=O)c1cccc(Nc2c(NC(c3cc(C)co3)C3(C)COC3)c(=O)c2=O)c1O
Show InChI InChI=1S/C23H25N3O6/c1-12-8-15(32-9-12)21(23(2)10-31-11-23)25-17-16(19(28)20(17)29)24-14-7-5-6-13(18(14)27)22(30)26(3)4/h5-9,21,24-25,27H,10-11H2,1-4H3
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n/an/a 32n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 2


(Homo sapiens (Human))		BDBM172328
PNG
(US9090596, 8)
Show SMILES COC(=O)[C@H]1CCCN1C(=O)c1cccc(Nc2c(N[C@@H](c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O |r|
Show InChI InChI=1S/C27H29N3O8/c1-14-9-10-18(38-14)24(27(2)12-37-13-27)29-20-19(22(32)23(20)33)28-16-7-4-6-15(21(16)31)25(34)30-11-5-8-17(30)26(35)36-3/h4,6-7,9-10,17,24,28-29,31H,5,8,11-13H2,1-3H3/t17-,24+/m1/s1
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n/an/a 37n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 2


(Homo sapiens (Human))		BDBM172329
PNG
(US9090596, 9)
Show SMILES COC(=O)[C@@H]1CCCN1C(=O)c1cccc(Nc2c(N[C@@H](c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O |r|
Show InChI InChI=1S/C27H29N3O8/c1-14-9-10-18(38-14)24(27(2)12-37-13-27)29-20-19(22(32)23(20)33)28-16-7-4-6-15(21(16)31)25(34)30-11-5-8-17(30)26(35)36-3/h4,6-7,9-10,17,24,28-29,31H,5,8,11-13H2,1-3H3/t17-,24-/m0/s1
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n/an/a 60n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 2


(Homo sapiens (Human))		BDBM172369
PNG
(US9090596, 50)
Show SMILES CN(C)C(=O)c1cccc(Nc2c(N[C@@H](c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O |r|
Show InChI InChI=1S/C23H25N3O6/c1-12-8-9-15(32-12)21(23(2)10-31-11-23)25-17-16(19(28)20(17)29)24-14-7-5-6-13(18(14)27)22(30)26(3)4/h5-9,21,24-25,27H,10-11H2,1-4H3/t21-/m0/s1
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n/an/a 72n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 2


(Homo sapiens (Human))		BDBM172370
PNG
(US9090596, 51)
Show SMILES CCN(C)C(=O)c1cccc(Nc2c(N[C@@H](c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O |r|
Show InChI InChI=1S/C24H27N3O6/c1-5-27(4)23(31)14-7-6-8-15(19(14)28)25-17-18(21(30)20(17)29)26-22(24(3)11-32-12-24)16-10-9-13(2)33-16/h6-10,22,25-26,28H,5,11-12H2,1-4H3/t22-/m0/s1
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n/an/a 72n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 2


(Homo sapiens (Human))		BDBM172345
PNG
(US9090596, 25)
Show SMILES CN(C)C(=O)c1scc(Nc2c(N[C@@H](c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O |r|
Show InChI InChI=1S/C21H23N3O6S/c1-10-5-6-12(30-10)19(21(2)8-29-9-21)23-14-13(16(26)17(14)27)22-11-7-31-18(15(11)25)20(28)24(3)4/h5-7,19,22-23,25H,8-9H2,1-4H3/t19-/m0/s1
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n/an/a 96n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 2


(Homo sapiens (Human))		BDBM172332
PNG
(US9090596, 12)
Show SMILES CC(C)C(=O)c1cccc(Nc2c(NC(c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O
Show InChI InChI=1S/C24H26N2O6/c1-12(2)19(27)14-6-5-7-15(20(14)28)25-17-18(22(30)21(17)29)26-23(24(4)10-31-11-24)16-9-8-13(3)32-16/h5-9,12,23,25-26,28H,10-11H2,1-4H3
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n/an/a 100n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 2


(Homo sapiens (Human))		BDBM172327
PNG
(US9090596, 7)
Show SMILES Cc1ccc(o1)C(Nc1c(Nc2cccc(C(=O)N3CCC[C@@H]3C(=O)OC(C)(C)C)c2O)c(=O)c1=O)C1(C)COC1 |r|
Show InChI InChI=1S/C30H35N3O8/c1-16-11-12-20(40-16)26(30(5)14-39-15-30)32-22-21(24(35)25(22)36)31-18-9-6-8-17(23(18)34)27(37)33-13-7-10-19(33)28(38)41-29(2,3)4/h6,8-9,11-12,19,26,31-32,34H,7,10,13-15H2,1-5H3/t19-,26?/m1/s1
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n/an/a 100n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 2


(Homo sapiens (Human))		BDBM172323
PNG
(US9090596, 3)
Show SMILES CCC1(COC1)C(Nc1c(Nc2cccc(C(=O)N(C)C)c2O)c(=O)c1=O)c1ccc(C)o1
Show InChI InChI=1S/C24H27N3O6/c1-5-24(11-32-12-24)22(16-10-9-13(2)33-16)26-18-17(20(29)21(18)30)25-15-8-6-7-14(19(15)28)23(31)27(3)4/h6-10,22,25-26,28H,5,11-12H2,1-4H3
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n/an/a 106n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 2


(Homo sapiens (Human))		BDBM172354
PNG
(US9090596, 34)
Show SMILES CN(C)C(=O)c1cccc(Nc2c(NC(c3cccs3)C3(C)COC3)c(=O)c2=O)c1O
Show InChI InChI=1S/C22H23N3O5S/c1-22(10-30-11-22)20(14-8-5-9-31-14)24-16-15(18(27)19(16)28)23-13-7-4-6-12(17(13)26)21(29)25(2)3/h4-9,20,23-24,26H,10-11H2,1-3H3
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n/an/a 106n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1


(Homo sapiens (Human))		BDBM172372
PNG
(US9090596, 53)
Show SMILES CN1CCN(CC1)S(=O)(=O)c1c(Cl)ccc(Nc2c(N[C@@H](c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O |r|
Show InChI InChI=1S/C25H29ClN4O7S/c1-14-4-7-17(37-14)24(25(2)12-36-13-25)28-19-18(21(32)22(19)33)27-16-6-5-15(26)23(20(16)31)38(34,35)30-10-8-29(3)9-11-30/h4-7,24,27-28,31H,8-13H2,1-3H3/t24-/m0/s1
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n/an/a 115n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1


(Homo sapiens (Human))		BDBM172342
PNG
(US9090596, 22)
Show SMILES CN(C)S(=O)(=O)c1c(Cl)ccc(Nc2c(NC(c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O
Show InChI InChI=1S/C22H24ClN3O7S/c1-11-5-8-14(33-11)21(22(2)9-32-10-22)25-16-15(18(28)19(16)29)24-13-7-6-12(23)20(17(13)27)34(30,31)26(3)4/h5-8,21,24-25,27H,9-10H2,1-4H3
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n/an/a 117n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 2


(Homo sapiens (Human))		BDBM172355
PNG
(US9090596, 35)
Show SMILES CN(C)C(=O)c1cccc(Nc2c(NC(c3ccc(C)s3)C3(C)COC3)c(=O)c2=O)c1O
Show InChI InChI=1S/C23H25N3O5S/c1-12-8-9-15(32-12)21(23(2)10-31-11-23)25-17-16(19(28)20(17)29)24-14-7-5-6-13(18(14)27)22(30)26(3)4/h5-9,21,24-25,27H,10-11H2,1-4H3
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n/an/a 146n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 2


(Homo sapiens (Human))		BDBM172356
PNG
(US9090596, 36)
Show SMILES CN(C)C(=O)c1cccc(Nc2c(NC(c3ccco3)C3(C)COC3)c(=O)c2=O)c1O
Show InChI InChI=1S/C22H23N3O6/c1-22(10-30-11-22)20(14-8-5-9-31-14)24-16-15(18(27)19(16)28)23-13-7-4-6-12(17(13)26)21(29)25(2)3/h4-9,20,23-24,26H,10-11H2,1-3H3
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n/an/a 198n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 2


(Homo sapiens (Human))		BDBM172357
PNG
(US9090596, 37a | US9090596, 37b)
Show SMILES CN(C)C(=O)c1cccc(Nc2c(NC(c3cc(C)co3)C3(C)COC3)c(=O)c2=O)c1O
Show InChI InChI=1S/C23H25N3O6/c1-12-8-15(32-9-12)21(23(2)10-31-11-23)25-17-16(19(28)20(17)29)24-14-7-5-6-13(18(14)27)22(30)26(3)4/h5-9,21,24-25,27H,10-11H2,1-4H3
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n/an/a 207n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))		BDBM172328
PNG
(US9090596, 8)
Show SMILES COC(=O)[C@H]1CCCN1C(=O)c1cccc(Nc2c(N[C@@H](c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O |r|
Show InChI InChI=1S/C27H29N3O8/c1-14-9-10-18(38-14)24(27(2)12-37-13-27)29-20-19(22(32)23(20)33)28-16-7-4-6-15(21(16)31)25(34)30-11-5-8-17(30)26(35)36-3/h4,6-7,9-10,17,24,28-29,31H,5,8,11-13H2,1-3H3/t17-,24+/m1/s1
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n/an/a 240n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The experiments were carried out on the FLIPR TETRA.RTM. platform from Molecular Devices. After the basal level had been read, the compounds were add...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 2


(Homo sapiens (Human))		BDBM172347
PNG
(US9090596, 27)
Show SMILES CN(C)C(=O)c1cccc(Nc2c(NC(c3cc(C)c(C)o3)C3(C)COC3)c(=O)c2=O)c1O
Show InChI InChI=1S/C24H27N3O6/c1-12-9-16(33-13(12)2)22(24(3)10-32-11-24)26-18-17(20(29)21(18)30)25-15-8-6-7-14(19(15)28)23(31)27(4)5/h6-9,22,25-26,28H,10-11H2,1-5H3
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n/an/a 244n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 2


(Homo sapiens (Human))		BDBM172341
PNG
(US9090596, 21)
Show SMILES CN(C)S(=O)(=O)c1cccc(Nc2c(NC(c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O
Show InChI InChI=1S/C22H25N3O7S/c1-12-8-9-14(32-12)21(22(2)10-31-11-22)24-17-16(19(27)20(17)28)23-13-6-5-7-15(18(13)26)33(29,30)25(3)4/h5-9,21,23-24,26H,10-11H2,1-4H3
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n/an/a 257n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 2


(Homo sapiens (Human))		BDBM172334
PNG
(US9090596, 14)
Show SMILES Cc1ccc(o1)C(Nc1c(Nc2cccc(C(=O)N3CCCC3)c2O)c(=O)c1=O)C1(C)COC1
Show InChI InChI=1S/C25H27N3O6/c1-14-8-9-17(34-14)23(25(2)12-33-13-25)27-19-18(21(30)22(19)31)26-16-7-5-6-15(20(16)29)24(32)28-10-3-4-11-28/h5-9,23,26-27,29H,3-4,10-13H2,1-2H3
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n/an/a 262n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 2


(Homo sapiens (Human))		BDBM172322
PNG
(US9090596, 2)
Show SMILES CN(C)C(=O)c1cccc(Nc2c(NC(c3ccc(C)o3)C3(CF)COC3)c(=O)c2=O)c1O
Show InChI InChI=1S/C23H24FN3O6/c1-12-7-8-15(33-12)21(23(9-24)10-32-11-23)26-17-16(19(29)20(17)30)25-14-6-4-5-13(18(14)28)22(31)27(2)3/h4-8,21,25-26,28H,9-11H2,1-3H3
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n/an/a 272n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 2


(Homo sapiens (Human))		BDBM172362
PNG
(US9090596, 42)
Show SMILES Cc1ccc(o1)C(Nc1c(Nc2cccc(C#N)c2O)c(=O)c1=O)C1(C)COC1
Show InChI InChI=1S/C21H19N3O5/c1-11-6-7-14(29-11)20(21(2)9-28-10-21)24-16-15(18(26)19(16)27)23-13-5-3-4-12(8-22)17(13)25/h3-7,20,23-25H,9-10H2,1-2H3
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n/an/a 311n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1


(Homo sapiens (Human))		BDBM172369
PNG
(US9090596, 50)
Show SMILES CN(C)C(=O)c1cccc(Nc2c(N[C@@H](c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O |r|
Show InChI InChI=1S/C23H25N3O6/c1-12-8-9-15(32-12)21(23(2)10-31-11-23)25-17-16(19(28)20(17)29)24-14-7-5-6-13(18(14)27)22(30)26(3)4/h5-9,21,24-25,27H,10-11H2,1-4H3/t21-/m0/s1
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n/an/a 312n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1


(Homo sapiens (Human))		BDBM172358
PNG
(US9090596, 38)
Show SMILES CC(C)c1coc(c1)C(Nc1c(Nc2cccc(C(=O)N(C)C)c2O)c(=O)c1=O)C1(C)COC1
Show InChI InChI=1S/C25H29N3O6/c1-13(2)14-9-17(34-10-14)23(25(3)11-33-12-25)27-19-18(21(30)22(19)31)26-16-8-6-7-15(20(16)29)24(32)28(4)5/h6-10,13,23,26-27,29H,11-12H2,1-5H3
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n/an/a 322n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 2


(Homo sapiens (Human))		BDBM172340
PNG
(US9090596, 20)
Show SMILES Cc1ccc(o1)C(Nc1c(Nc2cccnc2O)c(=O)c1=O)C1(C)COC1
Show InChI InChI=1S/C19H19N3O5/c1-10-5-6-12(27-10)17(19(2)8-26-9-19)22-14-13(15(23)16(14)24)21-11-4-3-7-20-18(11)25/h3-7,17,21-22H,8-9H2,1-2H3,(H,20,25)
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n/an/a 335n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 2


(Homo sapiens (Human))		BDBM172325
PNG
(US9090596, 5)
Show SMILES Cc1ccc(o1)C(Nc1c(Nc2cccc(C(=O)N3CC[C@@H](O)C3)c2O)c(=O)c1=O)C1(C)COC1 |r|
Show InChI InChI=1S/C25H27N3O7/c1-13-6-7-17(35-13)23(25(2)11-34-12-25)27-19-18(21(31)22(19)32)26-16-5-3-4-15(20(16)30)24(33)28-9-8-14(29)10-28/h3-7,14,23,26-27,29-30H,8-12H2,1-2H3/t14-,23?/m1/s1
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n/an/a 341n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 2


(Homo sapiens (Human))		BDBM172350
PNG
(US9090596, 30)
Show SMILES CN(C)C(=O)c1cccc(Nc2c(NC(c3ccc4OCOc4c3)C3(C)COC3)c(=O)c2=O)c1O
Show InChI InChI=1S/C25H25N3O7/c1-25(10-33-11-25)23(13-7-8-16-17(9-13)35-12-34-16)27-19-18(21(30)22(19)31)26-15-6-4-5-14(20(15)29)24(32)28(2)3/h4-9,23,26-27,29H,10-12H2,1-3H3
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n/an/a 349n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 2


(Homo sapiens (Human))		BDBM172371
PNG
(US9090596, 52)
Show SMILES CN(C)C(=O)c1c(Cl)ccc(Nc2c(N[C@@H](c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O |r|
Show InChI InChI=1S/C23H24ClN3O6/c1-11-5-8-14(33-11)21(23(2)9-32-10-23)26-17-16(19(29)20(17)30)25-13-7-6-12(24)15(18(13)28)22(31)27(3)4/h5-8,21,25-26,28H,9-10H2,1-4H3/t21-/m0/s1
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n/an/a 373n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 2


(Homo sapiens (Human))		BDBM172339
PNG
(US9090596, 19)
Show SMILES Cc1ccc(o1)C(Nc1c(Nc2cccn(C)c2=O)c(=O)c1=O)C1(C)COC1
Show InChI InChI=1S/C20H21N3O5/c1-11-6-7-13(28-11)18(20(2)9-27-10-20)22-15-14(16(24)17(15)25)21-12-5-4-8-23(3)19(12)26/h4-8,18,21-22H,9-10H2,1-3H3
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n/an/a 394n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 2


(Homo sapiens (Human))		BDBM172349
PNG
(US9090596, 29)
Show SMILES COc1ccc(cc1)C(Nc1c(Nc2cccc(C(=O)N(C)C)c2O)c(=O)c1=O)C1(C)COC1
Show InChI InChI=1S/C25H27N3O6/c1-25(12-34-13-25)23(14-8-10-15(33-4)11-9-14)27-19-18(21(30)22(19)31)26-17-7-5-6-16(20(17)29)24(32)28(2)3/h5-11,23,26-27,29H,12-13H2,1-4H3
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n/an/a 433n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-C chemokine receptor type 4


(Homo sapiens (Human))		BDBM172372
PNG
(US9090596, 53)
Show SMILES CN1CCN(CC1)S(=O)(=O)c1c(Cl)ccc(Nc2c(N[C@@H](c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O |r|
Show InChI InChI=1S/C25H29ClN4O7S/c1-14-4-7-17(37-14)24(25(2)12-36-13-25)28-19-18(21(32)22(19)33)27-16-6-5-15(26)23(20(16)31)38(34,35)30-10-8-29(3)9-11-30/h4-7,24,27-28,31H,8-13H2,1-3H3/t24-/m0/s1
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n/an/a 450n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The experiments were carried out on the FLIPR TETRA.RTM. platform from Molecular Devices. After the basal level had been read, the compounds were add...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 2


(Homo sapiens (Human))		BDBM172348
PNG
(US9090596, 28)
Show SMILES COc1cccc(c1)C(Nc1c(Nc2cccc(C(=O)N(C)C)c2O)c(=O)c1=O)C1(C)COC1
Show InChI InChI=1S/C25H27N3O6/c1-25(12-34-13-25)23(14-7-5-8-15(11-14)33-4)27-19-18(21(30)22(19)31)26-17-10-6-9-16(20(17)29)24(32)28(2)3/h5-11,23,26-27,29H,12-13H2,1-4H3
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n/an/a 475n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 2


(Homo sapiens (Human))		BDBM172360
PNG
(US9090596, 40)
Show SMILES Cc1ccc(o1)C(Nc1c(Nc2ccc(Cl)nc2O)c(=O)c1=O)C1(C)COC1
Show InChI InChI=1S/C19H18ClN3O5/c1-9-3-5-11(28-9)17(19(2)7-27-8-19)23-14-13(15(24)16(14)25)21-10-4-6-12(20)22-18(10)26/h3-6,17,21,23H,7-8H2,1-2H3,(H,22,26)
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n/an/a 502n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 2


(Homo sapiens (Human))		BDBM172331
PNG
(US9090596, 11)
Show SMILES CC(O)c1cccc(Nc2c(NC(c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O
Show InChI InChI=1S/C22H24N2O6/c1-11-7-8-15(30-11)21(22(3)9-29-10-22)24-17-16(19(27)20(17)28)23-14-6-4-5-13(12(2)25)18(14)26/h4-8,12,21,23-26H,9-10H2,1-3H3
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n/an/a 549n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1


(Homo sapiens (Human))		BDBM172368
PNG
(US9090596, 48)
Show SMILES CN(CC(F)(F)F)C(=O)c1cccc(Nc2c(N[C@@H](c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O |r|
Show InChI InChI=1S/C24H24F3N3O6/c1-12-7-8-15(36-12)21(23(2)10-35-11-23)29-17-16(19(32)20(17)33)28-14-6-4-5-13(18(14)31)22(34)30(3)9-24(25,26)27/h4-8,21,28-29,31H,9-11H2,1-3H3/t21-/m0/s1
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n/an/a 566n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1


(Homo sapiens (Human))		BDBM172328
PNG
(US9090596, 8)
Show SMILES COC(=O)[C@H]1CCCN1C(=O)c1cccc(Nc2c(N[C@@H](c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O |r|
Show InChI InChI=1S/C27H29N3O8/c1-14-9-10-18(38-14)24(27(2)12-37-13-27)29-20-19(22(32)23(20)33)28-16-7-4-6-15(21(16)31)25(34)30-11-5-8-17(30)26(35)36-3/h4,6-7,9-10,17,24,28-29,31H,5,8,11-13H2,1-3H3/t17-,24+/m1/s1
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n/an/a 604n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 2


(Homo sapiens (Human))		BDBM172335
PNG
(US9090596, 15)
Show SMILES Cc1ccc(o1)C(Nc1c(Nc2cccc(C(=O)N3CCOCC3)c2O)c(=O)c1=O)C1(C)COC1
Show InChI InChI=1S/C25H27N3O7/c1-14-6-7-17(35-14)23(25(2)12-34-13-25)27-19-18(21(30)22(19)31)26-16-5-3-4-15(20(16)29)24(32)28-8-10-33-11-9-28/h3-7,23,26-27,29H,8-13H2,1-2H3
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n/an/a 626n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1


(Homo sapiens (Human))		BDBM172370
PNG
(US9090596, 51)
Show SMILES CCN(C)C(=O)c1cccc(Nc2c(N[C@@H](c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O |r|
Show InChI InChI=1S/C24H27N3O6/c1-5-27(4)23(31)14-7-6-8-15(19(14)28)25-17-18(21(30)20(17)29)26-22(24(3)11-32-12-24)16-10-9-13(2)33-16/h6-10,22,25-26,28H,5,11-12H2,1-4H3/t22-/m0/s1
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n/an/a 650n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1


(Homo sapiens (Human))		BDBM172329
PNG
(US9090596, 9)
Show SMILES COC(=O)[C@@H]1CCCN1C(=O)c1cccc(Nc2c(N[C@@H](c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O |r|
Show InChI InChI=1S/C27H29N3O8/c1-14-9-10-18(38-14)24(27(2)12-37-13-27)29-20-19(22(32)23(20)33)28-16-7-4-6-15(21(16)31)25(34)30-11-5-8-17(30)26(35)36-3/h4,6-7,9-10,17,24,28-29,31H,5,8,11-13H2,1-3H3/t17-,24-/m0/s1
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n/an/a 666n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))		BDBM172369
PNG
(US9090596, 50)
Show SMILES CN(C)C(=O)c1cccc(Nc2c(N[C@@H](c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O |r|
Show InChI InChI=1S/C23H25N3O6/c1-12-8-9-15(32-12)21(23(2)10-31-11-23)25-17-16(19(28)20(17)29)24-14-7-5-6-13(18(14)27)22(30)26(3)4/h5-9,21,24-25,27H,10-11H2,1-4H3/t21-/m0/s1
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n/an/a 700n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The experiments were carried out on the FLIPR TETRA.RTM. platform from Molecular Devices. After the basal level had been read, the compounds were add...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 2


(Homo sapiens (Human))		BDBM172351
PNG
(US9090596, 31)
Show SMILES Cc1ccc(o1)C(Nc1c(Nc2cccc(c2)C(=O)N2CCC(O)C2)c(=O)c1=O)C1(C)COC1
Show InChI InChI=1S/C25H27N3O6/c1-14-6-7-18(34-14)23(25(2)12-33-13-25)27-20-19(21(30)22(20)31)26-16-5-3-4-15(10-16)24(32)28-9-8-17(29)11-28/h3-7,10,17,23,26-27,29H,8-9,11-13H2,1-2H3
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n/an/a 716n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 2


(Homo sapiens (Human))		BDBM172374
PNG
(US9090596, 49)
Show SMILES CN(C)C(=O)c1cccc(Nc2c(N[C@H](c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O |r|
Show InChI InChI=1S/C23H25N3O6/c1-12-8-9-15(32-12)21(23(2)10-31-11-23)25-17-16(19(28)20(17)29)24-14-7-5-6-13(18(14)27)22(30)26(3)4/h5-9,21,24-25,27H,10-11H2,1-4H3/t21-/m1/s1
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n/an/a 733n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1


(Homo sapiens (Human))		BDBM172357
PNG
(US9090596, 37a | US9090596, 37b)
Show SMILES CN(C)C(=O)c1cccc(Nc2c(NC(c3cc(C)co3)C3(C)COC3)c(=O)c2=O)c1O
Show InChI InChI=1S/C23H25N3O6/c1-12-8-15(32-9-12)21(23(2)10-31-11-23)25-17-16(19(28)20(17)29)24-14-7-5-6-13(18(14)27)22(30)26(3)4/h5-9,21,24-25,27H,10-11H2,1-4H3
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n/an/a 827n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1


(Homo sapiens (Human))		BDBM172371
PNG
(US9090596, 52)
Show SMILES CN(C)C(=O)c1c(Cl)ccc(Nc2c(N[C@@H](c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O |r|
Show InChI InChI=1S/C23H24ClN3O6/c1-11-5-8-14(33-11)21(23(2)9-32-10-23)26-17-16(19(29)20(17)30)25-13-7-6-12(24)15(18(13)28)22(31)27(3)4/h5-8,21,25-26,28H,9-10H2,1-4H3/t21-/m0/s1
PDB

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n/an/a 897n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))		BDBM172372
PNG
(US9090596, 53)
Show SMILES CN1CCN(CC1)S(=O)(=O)c1c(Cl)ccc(Nc2c(N[C@@H](c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O |r|
Show InChI InChI=1S/C25H29ClN4O7S/c1-14-4-7-17(37-14)24(25(2)12-36-13-25)28-19-18(21(32)22(19)33)27-16-6-5-15(26)23(20(16)31)38(34,35)30-10-8-29(3)9-11-30/h4-7,24,27-28,31H,8-13H2,1-3H3/t24-/m0/s1
PDB

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n/an/a 920n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The experiments were carried out on the FLIPR TETRA.RTM. platform from Molecular Devices. After the basal level had been read, the compounds were add...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 2


(Homo sapiens (Human))		BDBM172353
PNG
(US9090596, 33)
Show SMILES COC(=O)C1CCCN1C(=O)c1cccc(Nc2c(NC(c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O
Show InChI InChI=1S/C27H29N3O8/c1-14-9-10-18(38-14)24(27(2)12-37-13-27)29-20-19(22(32)23(20)33)28-16-7-4-6-15(21(16)31)25(34)30-11-5-8-17(30)26(35)36-3/h4,6-7,9-10,17,24,28-29,31H,5,8,11-13H2,1-3H3
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n/an/a 962n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 2


(Homo sapiens (Human))		BDBM172359
PNG
(US9090596, 39)
Show SMILES COc1ccc(Nc2c(NC(c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c(O)n1
Show InChI InChI=1S/C20H21N3O6/c1-10-4-6-12(29-10)18(20(2)8-28-9-20)23-15-14(16(24)17(15)25)21-11-5-7-13(27-3)22-19(11)26/h4-7,18,21,23H,8-9H2,1-3H3,(H,22,26)
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n/an/a 1.04E+3n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 2


(Homo sapiens (Human))		BDBM172326
PNG
(US9090596, 6)
Show SMILES Cc1ccc(o1)C(Nc1c(Nc2cccc(C(=O)N3CC[C@H](O)C3)c2O)c(=O)c1=O)C1(C)COC1 |r|
Show InChI InChI=1S/C25H27N3O7/c1-13-6-7-17(35-13)23(25(2)11-34-12-25)27-19-18(21(31)22(19)32)26-16-5-3-4-15(20(16)30)24(33)28-9-8-14(29)10-28/h3-7,14,23,26-27,29-30H,8-12H2,1-2H3/t14-,23?/m0/s1
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n/an/a 1.09E+3n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1


(Homo sapiens (Human))		BDBM172323
PNG
(US9090596, 3)
Show SMILES CCC1(COC1)C(Nc1c(Nc2cccc(C(=O)N(C)C)c2O)c(=O)c1=O)c1ccc(C)o1
Show InChI InChI=1S/C24H27N3O6/c1-5-24(11-32-12-24)22(16-10-9-13(2)33-16)26-18-17(20(29)21(18)30)25-15-8-6-7-14(19(15)28)23(31)27(3)4/h6-10,22,25-26,28H,5,11-12H2,1-4H3
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n/an/a 1.15E+3n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1


(Homo sapiens (Human))		BDBM172334
PNG
(US9090596, 14)
Show SMILES Cc1ccc(o1)C(Nc1c(Nc2cccc(C(=O)N3CCCC3)c2O)c(=O)c1=O)C1(C)COC1
Show InChI InChI=1S/C25H27N3O6/c1-14-8-9-17(34-14)23(25(2)12-33-13-25)27-19-18(21(30)22(19)31)26-16-7-5-6-15(20(16)29)24(32)28-10-3-4-11-28/h5-9,23,26-27,29H,3-4,10-13H2,1-2H3
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n/an/a 1.30E+3n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1


(Homo sapiens (Human))		BDBM172341
PNG
(US9090596, 21)
Show SMILES CN(C)S(=O)(=O)c1cccc(Nc2c(NC(c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O
Show InChI InChI=1S/C22H25N3O7S/c1-12-8-9-14(32-12)21(22(2)10-31-11-22)24-17-16(19(27)20(17)28)23-13-6-5-7-15(18(13)26)33(29,30)25(3)4/h5-9,21,23-24,26H,10-11H2,1-4H3
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n/an/a 1.44E+3n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-C chemokine receptor type 4


(Homo sapiens (Human))		BDBM172342
PNG
(US9090596, 22)
Show SMILES CN(C)S(=O)(=O)c1c(Cl)ccc(Nc2c(NC(c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O
Show InChI InChI=1S/C22H24ClN3O7S/c1-11-5-8-14(33-11)21(22(2)9-32-10-22)25-16-15(18(28)19(16)29)24-13-7-6-12(23)20(17(13)27)34(30,31)26(3)4/h5-8,21,24-25,27H,9-10H2,1-4H3
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n/an/a 1.50E+3n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The experiments were carried out on the FLIPR TETRA.RTM. platform from Molecular Devices. After the basal level had been read, the compounds were add...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1


(Homo sapiens (Human))		BDBM172347
PNG
(US9090596, 27)
Show SMILES CN(C)C(=O)c1cccc(Nc2c(NC(c3cc(C)c(C)o3)C3(C)COC3)c(=O)c2=O)c1O
Show InChI InChI=1S/C24H27N3O6/c1-12-9-16(33-13(12)2)22(24(3)10-32-11-24)26-18-17(20(29)21(18)30)25-15-8-6-7-14(19(15)28)23(31)27(4)5/h6-9,22,25-26,28H,10-11H2,1-5H3
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n/an/a 1.54E+3n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1


(Homo sapiens (Human))		BDBM172322
PNG
(US9090596, 2)
Show SMILES CN(C)C(=O)c1cccc(Nc2c(NC(c3ccc(C)o3)C3(CF)COC3)c(=O)c2=O)c1O
Show InChI InChI=1S/C23H24FN3O6/c1-12-7-8-15(33-12)21(23(9-24)10-32-11-23)26-17-16(19(29)20(17)30)25-14-6-4-5-13(18(14)28)22(31)27(2)3/h4-8,21,25-26,28H,9-11H2,1-3H3
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n/an/a 1.60E+3n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1


(Homo sapiens (Human))		BDBM172354
PNG
(US9090596, 34)
Show SMILES CN(C)C(=O)c1cccc(Nc2c(NC(c3cccs3)C3(C)COC3)c(=O)c2=O)c1O
Show InChI InChI=1S/C22H23N3O5S/c1-22(10-30-11-22)20(14-8-5-9-31-14)24-16-15(18(27)19(16)28)23-13-7-4-6-12(17(13)26)21(29)25(2)3/h4-9,20,23-24,26H,10-11H2,1-3H3
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n/an/a 1.61E+3n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1


(Homo sapiens (Human))		BDBM172356
PNG
(US9090596, 36)
Show SMILES CN(C)C(=O)c1cccc(Nc2c(NC(c3ccco3)C3(C)COC3)c(=O)c2=O)c1O
Show InChI InChI=1S/C22H23N3O6/c1-22(10-30-11-22)20(14-8-5-9-31-14)24-16-15(18(27)19(16)28)23-13-7-4-6-12(17(13)26)21(29)25(2)3/h4-9,20,23-24,26H,10-11H2,1-3H3
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n/an/a 1.71E+3n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1


(Homo sapiens (Human))		BDBM172350
PNG
(US9090596, 30)
Show SMILES CN(C)C(=O)c1cccc(Nc2c(NC(c3ccc4OCOc4c3)C3(C)COC3)c(=O)c2=O)c1O
Show InChI InChI=1S/C25H25N3O7/c1-25(10-33-11-25)23(13-7-8-16-17(9-13)35-12-34-16)27-19-18(21(30)22(19)31)26-15-6-4-5-14(20(15)29)24(32)28(2)3/h4-9,23,26-27,29H,10-12H2,1-3H3
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n/an/a 2.25E+3n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1


(Homo sapiens (Human))		BDBM172327
PNG
(US9090596, 7)
Show SMILES Cc1ccc(o1)C(Nc1c(Nc2cccc(C(=O)N3CCC[C@@H]3C(=O)OC(C)(C)C)c2O)c(=O)c1=O)C1(C)COC1 |r|
Show InChI InChI=1S/C30H35N3O8/c1-16-11-12-20(40-16)26(30(5)14-39-15-30)32-22-21(24(35)25(22)36)31-18-9-6-8-17(23(18)34)27(37)33-13-7-10-19(33)28(38)41-29(2,3)4/h6,8-9,11-12,19,26,31-32,34H,7,10,13-15H2,1-5H3/t19-,26?/m1/s1
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n/an/a 2.41E+3n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1


(Homo sapiens (Human))		BDBM172325
PNG
(US9090596, 5)
Show SMILES Cc1ccc(o1)C(Nc1c(Nc2cccc(C(=O)N3CC[C@@H](O)C3)c2O)c(=O)c1=O)C1(C)COC1 |r|
Show InChI InChI=1S/C25H27N3O7/c1-13-6-7-17(35-13)23(25(2)11-34-12-25)27-19-18(21(31)22(19)32)26-16-5-3-4-15(20(16)30)24(33)28-9-8-14(29)10-28/h3-7,14,23,26-27,29-30H,8-12H2,1-2H3/t14-,23?/m1/s1
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n/an/a 2.62E+3n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1


(Homo sapiens (Human))		BDBM172326
PNG
(US9090596, 6)
Show SMILES Cc1ccc(o1)C(Nc1c(Nc2cccc(C(=O)N3CC[C@H](O)C3)c2O)c(=O)c1=O)C1(C)COC1 |r|
Show InChI InChI=1S/C25H27N3O7/c1-13-6-7-17(35-13)23(25(2)11-34-12-25)27-19-18(21(31)22(19)32)26-16-5-3-4-15(20(16)30)24(33)28-9-8-14(29)10-28/h3-7,14,23,26-27,29-30H,8-12H2,1-2H3/t14-,23?/m0/s1
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n/an/a 2.84E+3n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1


(Homo sapiens (Human))		BDBM172355
PNG
(US9090596, 35)
Show SMILES CN(C)C(=O)c1cccc(Nc2c(NC(c3ccc(C)s3)C3(C)COC3)c(=O)c2=O)c1O
Show InChI InChI=1S/C23H25N3O5S/c1-12-8-9-15(32-12)21(23(2)10-31-11-23)25-17-16(19(28)20(17)29)24-14-7-5-6-13(18(14)27)22(30)26(3)4/h5-9,21,24-25,27H,10-11H2,1-4H3
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n/an/a 3.03E+3n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1


(Homo sapiens (Human))		BDBM172335
PNG
(US9090596, 15)
Show SMILES Cc1ccc(o1)C(Nc1c(Nc2cccc(C(=O)N3CCOCC3)c2O)c(=O)c1=O)C1(C)COC1
Show InChI InChI=1S/C25H27N3O7/c1-14-6-7-17(35-14)23(25(2)12-34-13-25)27-19-18(21(30)22(19)31)26-16-5-3-4-15(20(16)29)24(32)28-8-10-33-11-9-28/h3-7,23,26-27,29H,8-13H2,1-2H3
PDB

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n/an/a 3.17E+3n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 3


(Homo sapiens (Human))		BDBM172342
PNG
(US9090596, 22)
Show SMILES CN(C)S(=O)(=O)c1c(Cl)ccc(Nc2c(NC(c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O
Show InChI InChI=1S/C22H24ClN3O7S/c1-11-5-8-14(33-11)21(22(2)9-32-10-22)25-16-15(18(28)19(16)29)24-13-7-6-12(23)20(17(13)27)34(30,31)26(3)4/h5-8,21,24-25,27H,9-10H2,1-4H3
PDB

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n/an/a 3.30E+3n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The experiments were carried out on the FLIPR TETRA.RTM. platform from Molecular Devices. After the basal level had been read, the compounds were add...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1


(Homo sapiens (Human))		BDBM172351
PNG
(US9090596, 31)
Show SMILES Cc1ccc(o1)C(Nc1c(Nc2cccc(c2)C(=O)N2CCC(O)C2)c(=O)c1=O)C1(C)COC1
Show InChI InChI=1S/C25H27N3O6/c1-14-6-7-18(34-14)23(25(2)12-33-13-25)27-20-19(21(30)22(20)31)26-16-5-3-4-15(10-16)24(32)28-9-8-17(29)11-28/h3-7,10,17,23,26-27,29H,8-9,11-13H2,1-2H3
PDB

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n/an/a 3.53E+3n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1


(Homo sapiens (Human))		BDBM172345
PNG
(US9090596, 25)
Show SMILES CN(C)C(=O)c1scc(Nc2c(N[C@@H](c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O |r|
Show InChI InChI=1S/C21H23N3O6S/c1-10-5-6-12(30-10)19(21(2)8-29-9-21)23-14-13(16(26)17(14)27)22-11-7-31-18(15(11)25)20(28)24(3)4/h5-7,19,22-23,25H,8-9H2,1-4H3/t19-/m0/s1
PDB

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n/an/a 3.90E+3n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1


(Homo sapiens (Human))		BDBM172339
PNG
(US9090596, 19)
Show SMILES Cc1ccc(o1)C(Nc1c(Nc2cccn(C)c2=O)c(=O)c1=O)C1(C)COC1
Show InChI InChI=1S/C20H21N3O5/c1-11-6-7-13(28-11)18(20(2)9-27-10-20)22-15-14(16(24)17(15)25)21-12-5-4-8-23(3)19(12)26/h4-8,18,21-22H,9-10H2,1-3H3
PDB

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n/an/a 4.96E+3n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1


(Homo sapiens (Human))		BDBM172360
PNG
(US9090596, 40)
Show SMILES Cc1ccc(o1)C(Nc1c(Nc2ccc(Cl)nc2O)c(=O)c1=O)C1(C)COC1
Show InChI InChI=1S/C19H18ClN3O5/c1-9-3-5-11(28-9)17(19(2)7-27-8-19)23-14-13(15(24)16(14)25)21-10-4-6-12(20)22-18(10)26/h3-6,17,21,23H,7-8H2,1-2H3,(H,22,26)
PDB

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n/an/a 5.23E+3n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1


(Homo sapiens (Human))		BDBM172348
PNG
(US9090596, 28)
Show SMILES COc1cccc(c1)C(Nc1c(Nc2cccc(C(=O)N(C)C)c2O)c(=O)c1=O)C1(C)COC1
Show InChI InChI=1S/C25H27N3O6/c1-25(12-34-13-25)23(14-7-5-8-15(11-14)33-4)27-19-18(21(30)22(19)31)26-17-10-6-9-16(20(17)29)24(32)28(2)3/h5-11,23,26-27,29H,12-13H2,1-4H3
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n/an/a 5.54E+3n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1


(Homo sapiens (Human))		BDBM172331
PNG
(US9090596, 11)
Show SMILES CC(O)c1cccc(Nc2c(NC(c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O
Show InChI InChI=1S/C22H24N2O6/c1-11-7-8-15(30-11)21(22(3)9-29-10-22)24-17-16(19(27)20(17)28)23-14-6-4-5-13(12(2)25)18(14)26/h4-8,12,21,23-26H,9-10H2,1-3H3
PDB

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n/an/a 6.51E+3n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1


(Homo sapiens (Human))		BDBM172340
PNG
(US9090596, 20)
Show SMILES Cc1ccc(o1)C(Nc1c(Nc2cccnc2O)c(=O)c1=O)C1(C)COC1
Show InChI InChI=1S/C19H19N3O5/c1-10-5-6-12(27-10)17(19(2)8-26-9-19)22-14-13(15(23)16(14)24)21-11-4-3-7-20-18(11)25/h3-7,17,21-22H,8-9H2,1-2H3,(H,20,25)
PDB

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n/an/a 6.62E+3n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1


(Homo sapiens (Human))		BDBM172374
PNG
(US9090596, 49)
Show SMILES CN(C)C(=O)c1cccc(Nc2c(N[C@H](c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O |r|
Show InChI InChI=1S/C23H25N3O6/c1-12-8-9-15(32-12)21(23(2)10-31-11-23)25-17-16(19(28)20(17)29)24-14-7-5-6-13(18(14)27)22(30)26(3)4/h5-9,21,24-25,27H,10-11H2,1-4H3/t21-/m1/s1
PDB

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US Patent
n/an/a 7.39E+3n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1


(Homo sapiens (Human))		BDBM172357
PNG
(US9090596, 37a | US9090596, 37b)
Show SMILES CN(C)C(=O)c1cccc(Nc2c(NC(c3cc(C)co3)C3(C)COC3)c(=O)c2=O)c1O
Show InChI InChI=1S/C23H25N3O6/c1-12-8-15(32-9-12)21(23(2)10-31-11-23)25-17-16(19(28)20(17)29)24-14-7-5-6-13(18(14)27)22(30)26(3)4/h5-9,21,24-25,27H,10-11H2,1-4H3
PDB

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n/an/a 7.69E+3n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1


(Homo sapiens (Human))		BDBM172359
PNG
(US9090596, 39)
Show SMILES COc1ccc(Nc2c(NC(c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c(O)n1
Show InChI InChI=1S/C20H21N3O6/c1-10-4-6-12(29-10)18(20(2)8-28-9-20)23-15-14(16(24)17(15)25)21-11-5-7-13(27-3)22-19(11)26/h4-7,18,21,23H,8-9H2,1-3H3,(H,22,26)
PDB

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n/an/a 1.00E+4n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1


(Homo sapiens (Human))		BDBM172332
PNG
(US9090596, 12)
Show SMILES CC(C)C(=O)c1cccc(Nc2c(NC(c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O
Show InChI InChI=1S/C24H26N2O6/c1-12(2)19(27)14-6-5-7-15(20(14)28)25-17-18(22(30)21(17)29)26-23(24(4)10-31-11-24)16-9-8-13(3)32-16/h5-9,12,23,25-26,28H,10-11H2,1-4H3
PDB

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n/an/a 1.00E+4n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1


(Homo sapiens (Human))		BDBM172353
PNG
(US9090596, 33)
Show SMILES COC(=O)C1CCCN1C(=O)c1cccc(Nc2c(NC(c3ccc(C)o3)C3(C)COC3)c(=O)c2=O)c1O
Show InChI InChI=1S/C27H29N3O8/c1-14-9-10-18(38-14)24(27(2)12-37-13-27)29-20-19(22(32)23(20)33)28-16-7-4-6-15(21(16)31)25(34)30-11-5-8-17(30)26(35)36-3/h4,6-7,9-10,17,24,28-29,31H,5,8,11-13H2,1-3H3
PDB

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n/an/a 1.00E+4n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1


(Homo sapiens (Human))		BDBM172349
PNG
(US9090596, 29)
Show SMILES COc1ccc(cc1)C(Nc1c(Nc2cccc(C(=O)N(C)C)c2O)c(=O)c1=O)C1(C)COC1
Show InChI InChI=1S/C25H27N3O6/c1-25(12-34-13-25)23(14-8-10-15(33-4)11-9-14)27-19-18(21(30)22(19)31)26-17-7-5-6-16(20(17)29)24(32)28(2)3/h5-11,23,26-27,29H,12-13H2,1-4H3
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n/an/a 1.00E+4n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 1


(Homo sapiens (Human))		BDBM172362
PNG
(US9090596, 42)
Show SMILES Cc1ccc(o1)C(Nc1c(Nc2cccc(C#N)c2O)c(=O)c1=O)C1(C)COC1
Show InChI InChI=1S/C21H19N3O5/c1-11-6-7-14(29-11)20(21(2)9-28-10-21)24-16-15(18(26)19(16)27)23-13-5-3-4-12(8-22)17(13)25/h3-7,20,23-25H,9-10H2,1-2H3
PDB

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n/an/a 1.00E+4n/an/an/an/an/an/a



GALDERMA RESEARCH & DEVELOPMENT

US Patent


Assay Description
The in vitro affinity of the compounds of the present invention for the CXCR1 and CXCR2 receptors was determined on a functional test of the .beta.-a...

US Patent US9090596 (2015)


BindingDB Entry DOI: 10.7270/Q2M04462
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%