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Patent code US9428456

Compile Data Set for Download or QSAR

Found 501 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
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243718
PNG
(US9428456, 3.002)
Show SMILES Clc1ccc(cc1)C(=O)Nc1cc(CN2CCC(CC2)C(=O)NC2CCCCC2)ccn1
Show InChI InChI=1S/C25H31ClN4O2/c26-21-8-6-19(7-9-21)25(32)29-23-16-18(10-13-27-23)17-30-14-11-20(12-15-30)24(31)28-22-4-2-1-3-5-22/h6-10,13,16,20,22H,1-5,11-12,14-15,17H2,(H,28,31)(H,27,29,32)
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n/an/an/an/a 57n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243728
PNG
(US9428456, 1.346)
Show SMILES CCC(C)(C)NC(=O)C1CCN(Cc2cccc(NC(=O)c3cccc([n+]3[O-])C(F)(F)F)c2)CC1
Show InChI InChI=1S/C25H31F3N4O3/c1-4-24(2,3)30-22(33)18-11-13-31(14-12-18)16-17-7-5-8-19(15-17)29-23(34)20-9-6-10-21(32(20)35)25(26,27)28/h5-10,15,18H,4,11-14,16H2,1-3H3,(H,29,34)(H,30,33)
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n/an/an/an/a 1n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243787
PNG
(US9428456, 1.216)
Show SMILES FC(F)(F)c1ccnc(c1)C(=O)Nc1cccc(CN2CCC(CC2)C(=O)NC2CCCC2)c1
Show InChI InChI=1S/C25H29F3N4O2/c26-25(27,28)19-8-11-29-22(15-19)24(34)31-21-7-3-4-17(14-21)16-32-12-9-18(10-13-32)23(33)30-20-5-1-2-6-20/h3-4,7-8,11,14-15,18,20H,1-2,5-6,9-10,12-13,16H2,(H,30,33)(H,31,34)
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n/an/an/an/a 7n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243789
PNG
(US9428456, 1.218)
Show SMILES FC(F)(F)c1cccc(n1)C(=O)Nc1ccc(Cl)c(CN2CCC(CC2)C(=O)NC2CCCC2)c1
Show InChI InChI=1S/C25H28ClF3N4O2/c26-20-9-8-19(31-24(35)21-6-3-7-22(32-21)25(27,28)29)14-17(20)15-33-12-10-16(11-13-33)23(34)30-18-4-1-2-5-18/h3,6-9,14,16,18H,1-2,4-5,10-13,15H2,(H,30,34)(H,31,35)
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n/an/an/an/a 2n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243791
PNG
(US9428456, 1.220)
Show SMILES FC(F)(F)c1ccc(nc1)C(=O)Nc1ccc(Cl)c(CN2CCC(CC2)C(=O)NC2CCCC2)c1
Show InChI InChI=1S/C25H28ClF3N4O2/c26-21-7-6-20(32-24(35)22-8-5-18(14-30-22)25(27,28)29)13-17(21)15-33-11-9-16(10-12-33)23(34)31-19-3-1-2-4-19/h5-8,13-14,16,19H,1-4,9-12,15H2,(H,31,34)(H,32,35)
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n/an/an/an/a 1n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243795
PNG
(US9428456, 1.224)
Show SMILES Fc1ccc(nc1)C(=O)Nc1ccc(Cl)c(CN2CCC(CC2)C(=O)NC2CCCC2)c1
Show InChI InChI=1S/C24H28ClFN4O2/c25-21-7-6-20(29-24(32)22-8-5-18(26)14-27-22)13-17(21)15-30-11-9-16(10-12-30)23(31)28-19-3-1-2-4-19/h5-8,13-14,16,19H,1-4,9-12,15H2,(H,28,31)(H,29,32)
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n/an/an/an/a 0.400n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243799
PNG
(US9428456, 2.002)
Show SMILES CNC(=O)C1CCN(Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)CC1
Show InChI InChI=1S/C21H24ClN3O2/c1-23-20(26)17-9-11-25(12-10-17)14-15-3-2-4-19(13-15)24-21(27)16-5-7-18(22)8-6-16/h2-8,13,17H,9-12,14H2,1H3,(H,23,26)(H,24,27)
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n/an/an/an/a 3n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243803
PNG
(US9428456, 2.006)
Show SMILES Clc1ccc(cc1)C(=O)Nc1cccc(CN2CCC(CC2)C(=O)NC2CC2)c1
Show InChI InChI=1S/C23H26ClN3O2/c24-19-6-4-17(5-7-19)22(28)26-21-3-1-2-16(14-21)15-27-12-10-18(11-13-27)23(29)25-20-8-9-20/h1-7,14,18,20H,8-13,15H2,(H,25,29)(H,26,28)
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n/an/an/an/a 2n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243806
PNG
(US9428456, 2.009)
Show SMILES CCN(CC)C(=O)C1CCN(Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)CC1
Show InChI InChI=1S/C24H30ClN3O2/c1-3-28(4-2)24(30)20-12-14-27(15-13-20)17-18-6-5-7-22(16-18)26-23(29)19-8-10-21(25)11-9-19/h5-11,16,20H,3-4,12-15,17H2,1-2H3,(H,26,29)
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n/an/an/an/a 1n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243808
PNG
(US9428456, 2.011)
Show SMILES OC1CCC(CC1)NC(=O)C1CCN(Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)CC1 |(-1.33,-.77,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;,-4.62,;,-3.08,;-1.33,-6.93,;,-7.7,;1.33,-6.93,;,-9.24,;1.33,-10.01,;1.33,-11.55,;,-12.32,;,-13.86,;-1.33,-14.63,;-2.67,-13.86,;-4,-14.63,;-4,-16.17,;-2.67,-16.94,;-2.67,-18.48,;-1.33,-19.25,;,-18.48,;-1.33,-20.79,;,-21.56,;,-23.1,;-1.33,-23.87,;-1.33,-25.41,;-2.67,-23.1,;-2.67,-21.56,;-1.33,-16.17,;-1.33,-11.55,;-1.33,-10.01,)|
Show InChI InChI=1S/C26H32ClN3O3/c27-21-6-4-19(5-7-21)25(32)29-23-3-1-2-18(16-23)17-30-14-12-20(13-15-30)26(33)28-22-8-10-24(31)11-9-22/h1-7,16,20,22,24,31H,8-15,17H2,(H,28,33)(H,29,32)
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n/an/an/an/a 241n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243809
PNG
(US9428456, 2.012)
Show SMILES CC(C)(C)C1CCC(CC1)NC(=O)C1CCN(Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)CC1 |(-1.33,.77,;-1.33,-.77,;-2.87,-.77,;.21,-.77,;-1.33,-2.31,;-2.67,-3.08,;-2.67,-4.62,;-1.33,-5.39,;,-4.62,;,-3.08,;-1.33,-6.93,;,-7.7,;1.33,-6.93,;,-9.24,;1.33,-10.01,;1.33,-11.55,;,-12.32,;,-13.86,;-1.33,-14.63,;-2.67,-13.86,;-4,-14.63,;-4,-16.17,;-2.67,-16.94,;-2.67,-18.48,;-1.33,-19.25,;,-18.48,;-1.33,-20.79,;,-21.56,;,-23.1,;-1.33,-23.87,;-1.33,-25.41,;-2.67,-23.1,;-2.67,-21.56,;-1.33,-16.17,;-1.33,-11.55,;-1.33,-10.01,)|
Show InChI InChI=1S/C30H40ClN3O2/c1-30(2,3)24-9-13-26(14-10-24)32-29(36)23-15-17-34(18-16-23)20-21-5-4-6-27(19-21)33-28(35)22-7-11-25(31)12-8-22/h4-8,11-12,19,23-24,26H,9-10,13-18,20H2,1-3H3,(H,32,36)(H,33,35)
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n/an/an/an/a 1.05E+3n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243810
PNG
(US9428456, 2.013)
Show SMILES Clc1ccc(cc1)C(=O)Nc1cccc(CN2CCC(CC2)C(=O)NC2CCOCC2)c1
Show InChI InChI=1S/C25H30ClN3O3/c26-21-6-4-19(5-7-21)24(30)28-23-3-1-2-18(16-23)17-29-12-8-20(9-13-29)25(31)27-22-10-14-32-15-11-22/h1-7,16,20,22H,8-15,17H2,(H,27,31)(H,28,30)
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n/an/an/an/a 13n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243814
PNG
(US9428456, 2.017)
Show SMILES CC(C)(NC(=O)C1CCN(Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)CC1)c1ccccc1
Show InChI InChI=1S/C29H32ClN3O2/c1-29(2,24-8-4-3-5-9-24)32-28(35)23-15-17-33(18-16-23)20-21-7-6-10-26(19-21)31-27(34)22-11-13-25(30)14-12-22/h3-14,19,23H,15-18,20H2,1-2H3,(H,31,34)(H,32,35)
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n/an/an/an/a 219n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243817
PNG
(US9428456, 2.020)
Show SMILES Clc1ccc(cc1)C(=O)Nc1cccc(CN2CCC(CC2)C(=O)NC2CCc3ccccc23)c1
Show InChI InChI=1S/C29H30ClN3O2/c30-24-11-8-22(9-12-24)28(34)31-25-6-3-4-20(18-25)19-33-16-14-23(15-17-33)29(35)32-27-13-10-21-5-1-2-7-26(21)27/h1-9,11-12,18,23,27H,10,13-17,19H2,(H,31,34)(H,32,35)
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n/an/an/an/a 21n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243819
PNG
(US9428456, 2.022)
Show SMILES Clc1ccc(cc1)C(=O)Nc1cccc(CN2CCC(CC2)C(=O)NCc2ccccn2)c1
Show InChI InChI=1S/C26H27ClN4O2/c27-22-9-7-20(8-10-22)26(33)30-23-6-3-4-19(16-23)18-31-14-11-21(12-15-31)25(32)29-17-24-5-1-2-13-28-24/h1-10,13,16,21H,11-12,14-15,17-18H2,(H,29,32)(H,30,33)
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n/an/an/an/a 20n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243829
PNG
(US9428456, 2.032)
Show SMILES OCC1(CCCC1)NC(=O)C1CCN(Cc2cccc(NC(=O)c3ccc(Cl)cc3)c2)CC1
Show InChI InChI=1S/C26H32ClN3O3/c27-22-8-6-20(7-9-22)24(32)28-23-5-3-4-19(16-23)17-30-14-10-21(11-15-30)25(33)29-26(18-31)12-1-2-13-26/h3-9,16,21,31H,1-2,10-15,17-18H2,(H,28,32)(H,29,33)
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n/an/an/an/a 5n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243830
PNG
(US9428456, 2.033)
Show SMILES Clc1ccc(cc1)C(=O)Nc1cccc(CN2CCC(CC2)C(=O)NC2Cc3ccccc3C2)c1
Show InChI InChI=1S/C29H30ClN3O2/c30-25-10-8-21(9-11-25)28(34)31-26-7-3-4-20(16-26)19-33-14-12-22(13-15-33)29(35)32-27-17-23-5-1-2-6-24(23)18-27/h1-11,16,22,27H,12-15,17-19H2,(H,31,34)(H,32,35)
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n/an/an/an/a 9n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243833
PNG
(US9428456, 3.006)
Show SMILES Fc1ccc(cc1)C(=O)Nc1ccnc(CN2CCC(CC2)C(=O)NC2CCCCC2)c1
Show InChI InChI=1S/C25H31FN4O2/c26-20-8-6-18(7-9-20)24(31)29-22-10-13-27-23(16-22)17-30-14-11-19(12-15-30)25(32)28-21-4-2-1-3-5-21/h6-10,13,16,19,21H,1-5,11-12,14-15,17H2,(H,28,32)(H,27,29,31)
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n/an/an/an/a 56n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243847
PNG
(US9428456, 1.352)
Show SMILES CC(C)(C)NC(=O)C1CCN(Cc2cccc(NC(=O)c3cccc(c3)S(C)(=O)=O)c2)CC1
Show InChI InChI=1S/C25H33N3O4S/c1-25(2,3)27-24(30)19-11-13-28(14-12-19)17-18-7-5-9-21(15-18)26-23(29)20-8-6-10-22(16-20)33(4,31)32/h5-10,15-16,19H,11-14,17H2,1-4H3,(H,26,29)(H,27,30)
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n/an/an/an/a 71n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243848
PNG
(US9428456, 1.353)
Show SMILES CC(C)(C)NC(=O)C1CCN(Cc2cccc(NC(=O)c3ccc4ncsc4c3)c2)CC1
Show InChI InChI=1S/C25H30N4O2S/c1-25(2,3)28-24(31)18-9-11-29(12-10-18)15-17-5-4-6-20(13-17)27-23(30)19-7-8-21-22(14-19)32-16-26-21/h4-8,13-14,16,18H,9-12,15H2,1-3H3,(H,27,30)(H,28,31)
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n/an/an/an/a 3n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243863
PNG
(US9428456, 1.101)
Show SMILES Cc1ccc(cc1)C(=O)Nc1cccc(CN2CCC(CC2)C(=O)NC2CCCCC2)c1
Show InChI InChI=1S/C27H35N3O2/c1-20-10-12-22(13-11-20)26(31)29-25-9-5-6-21(18-25)19-30-16-14-23(15-17-30)27(32)28-24-7-3-2-4-8-24/h5-6,9-13,18,23-24H,2-4,7-8,14-17,19H2,1H3,(H,28,32)(H,29,31)
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n/an/an/an/a 4n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243884
PNG
(US9428456, 1.122)
Show SMILES COc1ccc(cc1C)C(=O)Nc1cccc(CN2CCC(CC2)C(=O)NC2CCCCC2)c1
Show InChI InChI=1S/C28H37N3O3/c1-20-17-23(11-12-26(20)34-2)28(33)30-25-10-6-7-21(18-25)19-31-15-13-22(14-16-31)27(32)29-24-8-4-3-5-9-24/h6-7,10-12,17-18,22,24H,3-5,8-9,13-16,19H2,1-2H3,(H,29,32)(H,30,33)
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n/an/an/an/a 15n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243900
PNG
(US9428456, 1.238)
Show SMILES CC(C)(C)NC(=O)C1CCN(Cc2cccc(NC(=O)c3ccc(cc3)C(F)(F)F)c2)CC1
Show InChI InChI=1S/C25H30F3N3O2/c1-24(2,3)30-23(33)19-11-13-31(14-12-19)16-17-5-4-6-21(15-17)29-22(32)18-7-9-20(10-8-18)25(26,27)28/h4-10,15,19H,11-14,16H2,1-3H3,(H,29,32)(H,30,33)
PDB

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n/an/an/an/a 4n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243905
PNG
(US9428456, 1.244)
Show SMILES CC(C)(C)NC(=O)C1CCN(Cc2cccc(NC(=O)Cc3ccc(Cl)cc3Cl)c2)CC1
Show InChI InChI=1S/C25H31Cl2N3O2/c1-25(2,3)29-24(32)18-9-11-30(12-10-18)16-17-5-4-6-21(13-17)28-23(31)14-19-7-8-20(26)15-22(19)27/h4-8,13,15,18H,9-12,14,16H2,1-3H3,(H,28,31)(H,29,32)
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n/an/an/an/a 5n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243939
PNG
(US9428456, 2.052)
Show SMILES Cc1cncc(c1)C(=O)Nc1cccc(CN2CCC(CC2)C(=O)N2CC[C@@H](F)C2)c1
Show InChI InChI=1S/C24H29FN4O2/c1-17-11-20(14-26-13-17)23(30)27-22-4-2-3-18(12-22)15-28-8-5-19(6-9-28)24(31)29-10-7-21(25)16-29/h2-4,11-14,19,21H,5-10,15-16H2,1H3,(H,27,30)/t21-/m1/s1
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n/an/an/an/a 121n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243940
PNG
(US9428456, 2.053)
Show SMILES Cc1cncc(c1)C(=O)Nc1cccc(CN2CCC(CC2)C(=O)N2CC[C@H](F)C2)c1
Show InChI InChI=1S/C24H29FN4O2/c1-17-11-20(14-26-13-17)23(30)27-22-4-2-3-18(12-22)15-28-8-5-19(6-9-28)24(31)29-10-7-21(25)16-29/h2-4,11-14,19,21H,5-10,15-16H2,1H3,(H,27,30)/t21-/m0/s1
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n/an/an/an/a 195n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243942
PNG
(US9428456, 2.055)
Show SMILES CN(C)C(=O)C1CCN(Cc2cccc(NC(=O)c3cncc(C)c3)c2)CC1
Show InChI InChI=1S/C22H28N4O2/c1-16-11-19(14-23-13-16)21(27)24-20-6-4-5-17(12-20)15-26-9-7-18(8-10-26)22(28)25(2)3/h4-6,11-14,18H,7-10,15H2,1-3H3,(H,24,27)
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n/an/an/an/a 60n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243945
PNG
(US9428456, 2.058)
Show SMILES COCCN(C)C(=O)C1CCN(Cc2cccc(NC(=O)c3cncc(C)c3)c2)CC1
Show InChI InChI=1S/C24H32N4O3/c1-18-13-21(16-25-15-18)23(29)26-22-6-4-5-19(14-22)17-28-9-7-20(8-10-28)24(30)27(2)11-12-31-3/h4-6,13-16,20H,7-12,17H2,1-3H3,(H,26,29)
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n/an/an/an/a 224n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243950
PNG
(US9428456, 2.063)
Show SMILES Cc1cncc(c1)C(=O)Nc1cccc(CN2CCC(C2)C(=O)NC2CCCCC2)c1
Show InChI InChI=1S/C25H32N4O2/c1-18-12-21(15-26-14-18)25(31)28-23-9-5-6-19(13-23)16-29-11-10-20(17-29)24(30)27-22-7-3-2-4-8-22/h5-6,9,12-15,20,22H,2-4,7-8,10-11,16-17H2,1H3,(H,27,30)(H,28,31)
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n/an/an/an/a 92n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243957
PNG
(US9428456, 4.009)
Show SMILES CC(C)(C)NC(=O)C1(F)CCN(Cc2cccc(NC(=O)c3cccc(n3)C(F)(F)F)c2)CC1
Show InChI InChI=1S/C24H28F4N4O2/c1-22(2,3)31-21(34)23(25)10-12-32(13-11-23)15-16-6-4-7-17(14-16)29-20(33)18-8-5-9-19(30-18)24(26,27)28/h4-9,14H,10-13,15H2,1-3H3,(H,29,33)(H,31,34)
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n/an/an/an/a 20n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243958
PNG
(US9428456, 4.010)
Show SMILES CC1(CCN(Cc2cccc(NC(=O)c3cccc(n3)C(F)(F)F)c2)CC1)C(=O)NC1CCCCC1
Show InChI InChI=1S/C27H33F3N4O2/c1-26(25(36)32-20-8-3-2-4-9-20)13-15-34(16-14-26)18-19-7-5-10-21(17-19)31-24(35)22-11-6-12-23(33-22)27(28,29)30/h5-7,10-12,17,20H,2-4,8-9,13-16,18H2,1H3,(H,31,35)(H,32,36)
PDB

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n/an/an/an/a 57n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243960
PNG
(US9428456, 4.012)
Show SMILES COc1cncc(c1)C(=O)Nc1cccc(CN2CCC(CC2)C(=O)NC2CCCCC2)c1
Show InChI InChI=1S/C26H34N4O3/c1-33-24-15-21(16-27-17-24)26(32)29-23-9-5-6-19(14-23)18-30-12-10-20(11-13-30)25(31)28-22-7-3-2-4-8-22/h5-6,9,14-17,20,22H,2-4,7-8,10-13,18H2,1H3,(H,28,31)(H,29,32)
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n/an/an/an/a 10n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243961
PNG
(US9428456, 4.013)
Show SMILES COc1cncc(c1)C(=O)Nc1cccc(CN2CCC(CC2)C(=O)NC2CCCC2)c1
Show InChI InChI=1S/C25H32N4O3/c1-32-23-14-20(15-26-16-23)25(31)28-22-8-4-5-18(13-22)17-29-11-9-19(10-12-29)24(30)27-21-6-2-3-7-21/h4-5,8,13-16,19,21H,2-3,6-7,9-12,17H2,1H3,(H,27,30)(H,28,31)
PDB

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n/an/an/an/a 9n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243978
PNG
(US9428456, 4.024)
Show SMILES CC(C)(C)NC(=O)C1CCN(Cc2cccc(NC(=O)c3ccc(Cl)c[n+]3[O-])c2)CC1
Show InChI InChI=1S/C23H29ClN4O3/c1-23(2,3)26-21(29)17-9-11-27(12-10-17)14-16-5-4-6-19(13-16)25-22(30)20-8-7-18(24)15-28(20)31/h4-8,13,15,17H,9-12,14H2,1-3H3,(H,25,30)(H,26,29)
PDB

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n/an/an/an/a 3n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243486
PNG
(US9428456, 1.005)
Show SMILES Cc1cc(no1)C(=O)Nc1cccc(CN2CCC(CC2)C(=O)NC2CCCCC2)c1
Show InChI InChI=1S/C24H32N4O3/c1-17-14-22(27-31-17)24(30)26-21-9-5-6-18(15-21)16-28-12-10-19(11-13-28)23(29)25-20-7-3-2-4-8-20/h5-6,9,14-15,19-20H,2-4,7-8,10-13,16H2,1H3,(H,25,29)(H,26,30)
PDB

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n/an/an/an/a 18n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243488
PNG
(US9428456, 1.007)
Show SMILES O=C(NC1CCCCC1)C1CCN(Cc2cccc(NC(=O)c3ccc4ccccc4c3)c2)CC1
Show InChI InChI=1S/C30H35N3O2/c34-29(31-27-10-2-1-3-11-27)24-15-17-33(18-16-24)21-22-7-6-12-28(19-22)32-30(35)26-14-13-23-8-4-5-9-25(23)20-26/h4-9,12-14,19-20,24,27H,1-3,10-11,15-18,21H2,(H,31,34)(H,32,35)
PDB

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n/an/an/an/a 6n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243490
PNG
(US9428456, 1.009)
Show SMILES COc1ccccc1C(=O)Nc1cccc(CN2CCC(CC2)C(=O)NC2CCCCC2)c1
Show InChI InChI=1S/C27H35N3O3/c1-33-25-13-6-5-12-24(25)27(32)29-23-11-7-8-20(18-23)19-30-16-14-21(15-17-30)26(31)28-22-9-3-2-4-10-22/h5-8,11-13,18,21-22H,2-4,9-10,14-17,19H2,1H3,(H,28,31)(H,29,32)
PDB

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n/an/an/an/a 17n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243493
PNG
(US9428456, 1.012)
Show SMILES O=C(NC1CCCCC1)C1CCN(Cc2cccc(NC(=O)c3ccsc3)c2)CC1
Show InChI InChI=1S/C24H31N3O2S/c28-23(25-21-6-2-1-3-7-21)19-9-12-27(13-10-19)16-18-5-4-8-22(15-18)26-24(29)20-11-14-30-17-20/h4-5,8,11,14-15,17,19,21H,1-3,6-7,9-10,12-13,16H2,(H,25,28)(H,26,29)
PDB

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n/an/an/an/a 4n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243499
PNG
(US9428456, 1.017)
Show SMILES O=C(Nc1cccc(CN2CCC(CC2)C(=O)NC2CCCCC2)c1)C1CCCC1
Show InChI InChI=1S/C25H37N3O2/c29-24(20-8-4-5-9-20)27-23-12-6-7-19(17-23)18-28-15-13-21(14-16-28)25(30)26-22-10-2-1-3-11-22/h6-7,12,17,20-22H,1-5,8-11,13-16,18H2,(H,26,30)(H,27,29)
PDB

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n/an/an/an/a 29n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243515
PNG
(US9428456, 1.130)
Show SMILES Fc1cc(Cl)ccc1C(=O)Nc1cccc(CN2CCC(CC2)C(=O)NC2CCCCC2)c1
Show InChI InChI=1S/C26H31ClFN3O2/c27-20-9-10-23(24(28)16-20)26(33)30-22-8-4-5-18(15-22)17-31-13-11-19(12-14-31)25(32)29-21-6-2-1-3-7-21/h4-5,8-10,15-16,19,21H,1-3,6-7,11-14,17H2,(H,29,32)(H,30,33)
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n/an/an/an/a 7n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243540
PNG
(US9428456, 1.155)
Show SMILES FC(F)(F)c1ccnc(c1)C(=O)Nc1cccc(CN2CCC(CC2)C(=O)NC2CCCCC2)c1
Show InChI InChI=1S/C26H31F3N4O2/c27-26(28,29)20-9-12-30-23(16-20)25(35)32-22-8-4-5-18(15-22)17-33-13-10-19(11-14-33)24(34)31-21-6-2-1-3-7-21/h4-5,8-9,12,15-16,19,21H,1-3,6-7,10-11,13-14,17H2,(H,31,34)(H,32,35)
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n/an/an/an/a 12n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243552
PNG
(US9428456, 1.266)
Show SMILES CC(C)(C)NC(=O)C1CCN(Cc2cccc(NC(=O)C3COc4ccccc34)c2)CC1
Show InChI InChI=1S/C26H33N3O3/c1-26(2,3)28-24(30)19-11-13-29(14-12-19)16-18-7-6-8-20(15-18)27-25(31)22-17-32-23-10-5-4-9-21(22)23/h4-10,15,19,22H,11-14,16-17H2,1-3H3,(H,27,31)(H,28,30)
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n/an/an/an/a 6n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243555
PNG
(US9428456, 1.269)
Show SMILES CC(C)(C)NC(=O)C1CCN(Cc2cccc(NC(=O)C(C)(C)c3ccc(Cl)cc3)c2)CC1
Show InChI InChI=1S/C27H36ClN3O2/c1-26(2,3)30-24(32)20-13-15-31(16-14-20)18-19-7-6-8-23(17-19)29-25(33)27(4,5)21-9-11-22(28)12-10-21/h6-12,17,20H,13-16,18H2,1-5H3,(H,29,33)(H,30,32)
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n/an/an/an/a 1n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243556
PNG
(US9428456, 1.270)
Show SMILES CC(C)(C)NC(=O)C1CCN(Cc2cccc(NC(=O)C(O)c3ccccc3Cl)c2)CC1
Show InChI InChI=1S/C25H32ClN3O3/c1-25(2,3)28-23(31)18-11-13-29(14-12-18)16-17-7-6-8-19(15-17)27-24(32)22(30)20-9-4-5-10-21(20)26/h4-10,15,18,22,30H,11-14,16H2,1-3H3,(H,27,32)(H,28,31)
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n/an/an/an/a 6n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243565
PNG
(US9428456, 1.279)
Show SMILES CC(C)(C)NC(=O)C1CCN(Cc2cc(Br)cc(NC(=O)c3cccc(n3)C(F)(F)F)c2)CC1
Show InChI InChI=1S/C24H28BrF3N4O2/c1-23(2,3)31-21(33)16-7-9-32(10-8-16)14-15-11-17(25)13-18(12-15)29-22(34)19-5-4-6-20(30-19)24(26,27)28/h4-6,11-13,16H,7-10,14H2,1-3H3,(H,29,34)(H,31,33)
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n/an/an/an/a 420n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243567
PNG
(US9428456, 1.281)
Show SMILES Cc1ccc(s1)C(=O)Nc1cccc(CN2CCC(CC2)C(=O)NC2CCCCC2)c1
Show InChI InChI=1S/C25H33N3O2S/c1-18-10-11-23(31-18)25(30)27-22-9-5-6-19(16-22)17-28-14-12-20(13-15-28)24(29)26-21-7-3-2-4-8-21/h5-6,9-11,16,20-21H,2-4,7-8,12-15,17H2,1H3,(H,26,29)(H,27,30)
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n/an/an/an/a 3n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243571
PNG
(US9428456, 1.285)
Show SMILES Cc1cncc(c1)C(=O)Nc1ccnc(CN2CCC(CC2)C(=O)NC2CCCCC2)n1
Show InChI InChI=1S/C24H32N6O2/c1-17-13-19(15-25-14-17)24(32)29-21-7-10-26-22(28-21)16-30-11-8-18(9-12-30)23(31)27-20-5-3-2-4-6-20/h7,10,13-15,18,20H,2-6,8-9,11-12,16H2,1H3,(H,27,31)(H,26,28,29,32)
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n/an/an/an/a 199n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243575
PNG
(US9428456, 1.289)
Show SMILES CC(C)NC(=O)C1CCCN(Cc2cccc(NC(=O)c3cncc(C)c3)c2)CC1
Show InChI InChI=1S/C24H32N4O2/c1-17(2)26-23(29)20-7-5-10-28(11-9-20)16-19-6-4-8-22(13-19)27-24(30)21-12-18(3)14-25-15-21/h4,6,8,12-15,17,20H,5,7,9-11,16H2,1-3H3,(H,26,29)(H,27,30)
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n/an/an/an/a 113n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243578
PNG
(US9428456, 1.293)
Show SMILES Clc1ccc(cc1)C(=O)Nc1nc(CN2CCC(CC2)C(=O)NC2CCCC2)cs1
Show InChI InChI=1S/C22H27ClN4O2S/c23-17-7-5-15(6-8-17)21(29)26-22-25-19(14-30-22)13-27-11-9-16(10-12-27)20(28)24-18-3-1-2-4-18/h5-8,14,16,18H,1-4,9-13H2,(H,24,28)(H,25,26,29)
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n/an/an/an/a 81n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
Atypical chemokine receptor 3


(Homo sapiens (Human))		BDBM243588
PNG
(US9428456, 2.077)
Show SMILES CN(C1CCCCC1)C(=O)C1CCN(Cc2cccc(NC(=O)c3cccs3)c2)CC1
Show InChI InChI=1S/C25H33N3O2S/c1-27(22-9-3-2-4-10-22)25(30)20-12-14-28(15-13-20)18-19-7-5-8-21(17-19)26-24(29)23-11-6-16-31-23/h5-8,11,16-17,20,22H,2-4,9-10,12-15,18H2,1H3,(H,26,29)
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n/an/an/an/a 87n/an/an/a37



ACTELION PHARMACEUTICALS LTD

US Patent


Assay Description
CHO-K1 CXCR7 b-arrestin cells are detached from culture dishes with a cell dissociation buffer (Invitrogen, #13151-014) and collected in growing medi...

US Patent US9428456 (2016)


BindingDB Entry DOI: 10.7270/Q29022PZ
More data for this
Ligand-Target Pair
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* indicates data uncertainty>20%