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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
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243727
PNG
(US9428456, 1.345)
Show SMILES CC(C)(C)NC(=O)C1CCN(Cc2cccc(NC(=O)c3cccc([n+]3[O-])C(F)(F)F)c2)CC1
Show InChI InChI=1S/C24H29F3N4O3/c1-23(2,3)29-21(32)17-10-12-30(13-11-17)15-16-6-4-7-18(14-16)28-22(33)19-8-5-9-20(31(19)34)24(25,26)27/h4-9,14,17H,10-13,15H2,1-3H3,(H,28,33)(H,29,32)
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n/an/an/an/a 1n/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243738
PNG
(US9428456, 1.069)
Show SMILES COc1ncccc1C(=O)Nc1cccc(CN2CCC(CC2)C(=O)NC2CCCCC2)c1
Show InChI InChI=1S/C26H34N4O3/c1-33-26-23(11-6-14-27-26)25(32)29-22-10-5-7-19(17-22)18-30-15-12-20(13-16-30)24(31)28-21-8-3-2-4-9-21/h5-7,10-11,14,17,20-21H,2-4,8-9,12-13,15-16,18H2,1H3,(H,28,31)(H,29,32)
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n/an/an/an/a 10n/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243742
PNG
(US9428456, 1.073)
Show SMILES O=C(NC1CCCCC1)C1CCN(Cc2cccc(NC(=O)c3cccnc3N3CCOCC3)c2)CC1
Show InChI InChI=1S/C29H39N5O3/c35-28(31-24-7-2-1-3-8-24)23-11-14-33(15-12-23)21-22-6-4-9-25(20-22)32-29(36)26-10-5-13-30-27(26)34-16-18-37-19-17-34/h4-6,9-10,13,20,23-24H,1-3,7-8,11-12,14-19,21H2,(H,31,35)(H,32,36)
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n/an/an/an/a 371n/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243778
PNG
(US9428456, 1.207)
Show SMILES Fc1ccc(nc1)C(=O)Nc1cccc(CN2CCC(CC2)C(=O)NC2CCCC2)c1
Show InChI InChI=1S/C24H29FN4O2/c25-19-8-9-22(26-15-19)24(31)28-21-7-3-4-17(14-21)16-29-12-10-18(11-13-29)23(30)27-20-5-1-2-6-20/h3-4,7-9,14-15,18,20H,1-2,5-6,10-13,16H2,(H,27,30)(H,28,31)
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n/an/an/an/a 0.800n/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243781
PNG
(US9428456, 1.210)
Show SMILES FC(F)(F)c1ccc(nc1)C(=O)Nc1cccc(CN2CCC(CC2)C(=O)NC2CCCC2)c1
Show InChI InChI=1S/C25H29F3N4O2/c26-25(27,28)19-8-9-22(29-15-19)24(34)31-21-7-3-4-17(14-21)16-32-12-10-18(11-13-32)23(33)30-20-5-1-2-6-20/h3-4,7-9,14-15,18,20H,1-2,5-6,10-13,16H2,(H,30,33)(H,31,34)
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n/an/an/an/a 0.600n/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243786
PNG
(US9428456, 1.215)
Show SMILES Fc1cncc(c1)C(=O)Nc1cccc(CN2CCC(CC2)C(=O)NC2CCCC2)c1
Show InChI InChI=1S/C24H29FN4O2/c25-20-13-19(14-26-15-20)24(31)28-22-7-3-4-17(12-22)16-29-10-8-18(9-11-29)23(30)27-21-5-1-2-6-21/h3-4,7,12-15,18,21H,1-2,5-6,8-11,16H2,(H,27,30)(H,28,31)
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n/an/an/an/a 2n/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(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/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243797
PNG
(US9428456, 1.226)
Show SMILES Cc1cncc(c1)C(=O)Nc1ccc(Cl)c(CN2CCC(CC2)C(=O)NC2CCCC2)c1
Show InChI InChI=1S/C25H31ClN4O2/c1-17-12-19(15-27-14-17)25(32)29-22-6-7-23(26)20(13-22)16-30-10-8-18(9-11-30)24(31)28-21-4-2-3-5-21/h6-7,12-15,18,21H,2-5,8-11,16H2,1H3,(H,28,31)(H,29,32)
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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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243816
PNG
(US9428456, 2.019)
Show SMILES Clc1ccc(cc1)C(=O)Nc1cccc(CN2CCC(CC2)C(=O)NC2CCCc3ccccc23)c1
Show InChI InChI=1S/C30H32ClN3O2/c31-25-13-11-23(12-14-25)29(35)32-26-8-3-5-21(19-26)20-34-17-15-24(16-18-34)30(36)33-28-10-4-7-22-6-1-2-9-27(22)28/h1-3,5-6,8-9,11-14,19,24,28H,4,7,10,15-18,20H2,(H,32,35)(H,33,36)
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n/an/an/an/a 40n/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243821
PNG
(US9428456, 2.024)
Show SMILES Clc1ccc(cc1)C(=O)Nc1cccc(CN2CCC(CC2)C(=O)NCc2nccs2)c1
Show InChI InChI=1S/C24H25ClN4O2S/c25-20-6-4-18(5-7-20)24(31)28-21-3-1-2-17(14-21)16-29-11-8-19(9-12-29)23(30)27-15-22-26-10-13-32-22/h1-7,10,13-14,19H,8-9,11-12,15-16H2,(H,27,30)(H,28,31)
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n/an/an/an/a 32n/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243825
PNG
(US9428456, 2.028)
Show SMILES COc1cccc(CNC(=O)C2CCN(Cc3cccc(NC(=O)c4ccc(Cl)cc4)c3)CC2)c1
Show InChI InChI=1S/C28H30ClN3O3/c1-35-26-7-3-4-20(17-26)18-30-27(33)23-12-14-32(15-13-23)19-21-5-2-6-25(16-21)31-28(34)22-8-10-24(29)11-9-22/h2-11,16-17,23H,12-15,18-19H2,1H3,(H,30,33)(H,31,34)
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n/an/an/an/a 394n/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(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/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243831
PNG
(US9428456, 2.034)
Show SMILES Cc1cc(CNC(=O)C2CCN(Cc3cccc(NC(=O)c4ccc(Cl)cc4)c3)CC2)c(o1)C(F)(F)F
Show InChI InChI=1S/C27H27ClF3N3O3/c1-17-13-21(24(37-17)27(29,30)31)15-32-25(35)20-9-11-34(12-10-20)16-18-3-2-4-23(14-18)33-26(36)19-5-7-22(28)8-6-19/h2-8,13-14,20H,9-12,15-16H2,1H3,(H,32,35)(H,33,36)
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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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243845
PNG
(US9428456, 4.005)
Show SMILES [O-][n+]1cc(F)ccc1C(=O)Nc1cccc(CN2CCC(CC2)C(=O)NC2CCCCC2)c1
Show InChI InChI=1S/C25H31FN4O3/c26-20-9-10-23(30(33)17-20)25(32)28-22-8-4-5-18(15-22)16-29-13-11-19(12-14-29)24(31)27-21-6-2-1-3-7-21/h4-5,8-10,15,17,19,21H,1-3,6-7,11-14,16H2,(H,27,31)(H,28,32)
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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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243849
PNG
(US9428456, 1.354)
Show SMILES Cc1nc2cc(ccc2s1)C(=O)Nc1cccc(CN2CCC(CC2)C(=O)NC(C)(C)C)c1
Show InChI InChI=1S/C26H32N4O2S/c1-17-27-22-15-20(8-9-23(22)33-17)24(31)28-21-7-5-6-18(14-21)16-30-12-10-19(11-13-30)25(32)29-26(2,3)4/h5-9,14-15,19H,10-13,16H2,1-4H3,(H,28,31)(H,29,32)
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n/an/an/an/a 108n/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243856
PNG
(US9428456, 2.101 | US9428456, 2.105)
Show SMILES C[C@H]1C[C@H](CCN1Cc1cccc(NC(=O)c2cccc(n2)C(F)(F)F)c1)C(=O)NC1CCCCC1
Show InChI InChI=1S/C27H33F3N4O2/c1-18-15-20(25(35)31-21-8-3-2-4-9-21)13-14-34(18)17-19-7-5-10-22(16-19)32-26(36)23-11-6-12-24(33-23)27(28,29)30/h5-7,10-12,16,18,20-21H,2-4,8-9,13-15,17H2,1H3,(H,31,35)(H,32,36)/t18-,20-/m0/s1
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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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243862
PNG
(US9428456, 1.100)
Show SMILES Cc1cccc(c1)C(=O)Nc1cccc(CN2CCC(CC2)C(=O)NC2CCCCC2)c1
Show InChI InChI=1S/C27H35N3O2/c1-20-7-5-9-23(17-20)27(32)29-25-12-6-8-21(18-25)19-30-15-13-22(14-16-30)26(31)28-24-10-3-2-4-11-24/h5-9,12,17-18,22,24H,2-4,10-11,13-16,19H2,1H3,(H,28,31)(H,29,32)
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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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243871
PNG
(US9428456, 1.109)
Show SMILES Cc1cccc(C(=O)Nc2cccc(CN3CCC(CC3)C(=O)NC3CCCCC3)c2)c1C
Show InChI InChI=1S/C28H37N3O2/c1-20-8-6-13-26(21(20)2)28(33)30-25-12-7-9-22(18-25)19-31-16-14-23(15-17-31)27(32)29-24-10-4-3-5-11-24/h6-9,12-13,18,23-24H,3-5,10-11,14-17,19H2,1-2H3,(H,29,32)(H,30,33)
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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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243878
PNG
(US9428456, 1.116)
Show SMILES Cc1ccc(F)c(c1)C(=O)Nc1cccc(CN2CCC(CC2)C(=O)NC2CCCCC2)c1
Show InChI InChI=1S/C27H34FN3O2/c1-19-10-11-25(28)24(16-19)27(33)30-23-9-5-6-20(17-23)18-31-14-12-21(13-15-31)26(32)29-22-7-3-2-4-8-22/h5-6,9-11,16-17,21-22H,2-4,7-8,12-15,18H2,1H3,(H,29,32)(H,30,33)
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n/an/an/an/a 6n/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243922
PNG
(US9428456, 2.035)
Show SMILES Clc1ccc(cc1)C(=O)Nc1cccc(CN2CCC(CC2)C(=O)NCc2ccccc2)c1
Show InChI InChI=1S/C27H28ClN3O2/c28-24-11-9-22(10-12-24)27(33)30-25-8-4-7-21(17-25)19-31-15-13-23(14-16-31)26(32)29-18-20-5-2-1-3-6-20/h1-12,17,23H,13-16,18-19H2,(H,29,32)(H,30,33)
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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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243936
PNG
(US9428456, 2.049)
Show SMILES Cc1cncc(c1)C(=O)Nc1cccc(CN2CCC(CC2)C(=O)N2CCC(F)(F)CC2)c1
Show InChI InChI=1S/C25H30F2N4O2/c1-18-13-21(16-28-15-18)23(32)29-22-4-2-3-19(14-22)17-30-9-5-20(6-10-30)24(33)31-11-7-25(26,27)8-12-31/h2-4,13-16,20H,5-12,17H2,1H3,(H,29,32)
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n/an/an/an/a 300n/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243943
PNG
(US9428456, 2.056)
Show SMILES CCCN(C)C(=O)C1CCN(Cc2cccc(NC(=O)c3cncc(C)c3)c2)CC1
Show InChI InChI=1S/C24H32N4O2/c1-4-10-27(3)24(30)20-8-11-28(12-9-20)17-19-6-5-7-22(14-19)26-23(29)21-13-18(2)15-25-16-21/h5-7,13-16,20H,4,8-12,17H2,1-3H3,(H,26,29)
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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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243963
PNG
(US9428456, 4.015)
Show SMILES COc1cncc(c1)C(=O)Nc1cccc(CN2CCC(CC2)C(=O)N(C)CC(C)C)c1
Show InChI InChI=1S/C25H34N4O3/c1-18(2)16-28(3)25(31)20-8-10-29(11-9-20)17-19-6-5-7-22(12-19)27-24(30)21-13-23(32-4)15-26-14-21/h5-7,12-15,18,20H,8-11,16-17H2,1-4H3,(H,27,30)
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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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243484
PNG
(US9428456, 1.003)
Show SMILES O=C(NC1CCCCC1)C1CCN(Cc2cccc(NC(=O)c3cccnc3)c2)CC1
Show InChI InChI=1S/C25H32N4O2/c30-24(27-22-8-2-1-3-9-22)20-11-14-29(15-12-20)18-19-6-4-10-23(16-19)28-25(31)21-7-5-13-26-17-21/h4-7,10,13,16-17,20,22H,1-3,8-9,11-12,14-15,18H2,(H,27,30)(H,28,31)
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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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(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)
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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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243504
PNG
(US9428456, 1.023)
Show SMILES COc1cccc(c1)C(=O)Nc1cccc(CN2CCC(CC2)C(=O)NC2CCCCC2)c1
Show InChI InChI=1S/C27H35N3O3/c1-33-25-12-6-8-22(18-25)27(32)29-24-11-5-7-20(17-24)19-30-15-13-21(14-16-30)26(31)28-23-9-3-2-4-10-23/h5-8,11-12,17-18,21,23H,2-4,9-10,13-16,19H2,1H3,(H,28,31)(H,29,32)
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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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243512
PNG
(US9428456, 1.031)
Show SMILES COc1ccc(cc1)C(=O)Nc1cccc(CN2CCC(CC2)C(=O)NC2CCCCC2)c1
Show InChI InChI=1S/C27H35N3O3/c1-33-25-12-10-21(11-13-25)26(31)29-24-9-5-6-20(18-24)19-30-16-14-22(15-17-30)27(32)28-23-7-3-2-4-8-23/h5-6,9-13,18,22-23H,2-4,7-8,14-17,19H2,1H3,(H,28,32)(H,29,31)
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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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243513
PNG
(US9428456, 1.032)
Show SMILES CC(C)(C)c1ccc(cc1)C(=O)Nc1cccc(CN2CCC(CC2)C(=O)NC2CCCCC2)c1
Show InChI InChI=1S/C30H41N3O2/c1-30(2,3)25-14-12-23(13-15-25)28(34)32-27-11-7-8-22(20-27)21-33-18-16-24(17-19-33)29(35)31-26-9-5-4-6-10-26/h7-8,11-15,20,24,26H,4-6,9-10,16-19,21H2,1-3H3,(H,31,35)(H,32,34)
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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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(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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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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243521
PNG
(US9428456, 1.136)
Show SMILES FC(F)(F)c1cc(cc(c1)C(F)(F)F)C(=O)Nc1cccc(CN2CCC(CC2)C(=O)NC2CCCCC2)c1
Show InChI InChI=1S/C28H31F6N3O2/c29-27(30,31)21-14-20(15-22(16-21)28(32,33)34)26(39)36-24-8-4-5-18(13-24)17-37-11-9-19(10-12-37)25(38)35-23-6-2-1-3-7-23/h4-5,8,13-16,19,23H,1-3,6-7,9-12,17H2,(H,35,38)(H,36,39)
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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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243529
PNG
(US9428456, 1.144)
Show SMILES CN(C)c1cccc(c1)C(=O)Nc1cccc(CN2CCC(CC2)C(=O)NC2CCCCC2)c1
Show InChI InChI=1S/C28H38N4O2/c1-31(2)26-13-7-9-23(19-26)28(34)30-25-12-6-8-21(18-25)20-32-16-14-22(15-17-32)27(33)29-24-10-4-3-5-11-24/h6-9,12-13,18-19,22,24H,3-5,10-11,14-17,20H2,1-2H3,(H,29,33)(H,30,34)
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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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243530
PNG
(US9428456, 1.145)
Show SMILES Fc1cccc(c1C(=O)Nc1cccc(CN2CCC(CC2)C(=O)NC2CCCCC2)c1)C(F)(F)F
Show InChI InChI=1S/C27H31F4N3O2/c28-23-11-5-10-22(27(29,30)31)24(23)26(36)33-21-9-4-6-18(16-21)17-34-14-12-19(13-15-34)25(35)32-20-7-2-1-3-8-20/h4-6,9-11,16,19-20H,1-3,7-8,12-15,17H2,(H,32,35)(H,33,36)
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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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243532
PNG
(US9428456, 1.147)
Show SMILES O=C(NC1CCCCC1)C1CCN(Cc2cccc(NC(=O)c3cncc(c3)C3CC3)c2)CC1
Show InChI InChI=1S/C28H36N4O2/c33-27(30-25-6-2-1-3-7-25)22-11-13-32(14-12-22)19-20-5-4-8-26(15-20)31-28(34)24-16-23(17-29-18-24)21-9-10-21/h4-5,8,15-18,21-22,25H,1-3,6-7,9-14,19H2,(H,30,33)(H,31,34)
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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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243536
PNG
(US9428456, 1.151)
Show SMILES O=C(NC1CCCCC1)C1CCN(Cc2cccc(NC(=O)C3CCCCC3)c2)CC1
Show InChI InChI=1S/C26H39N3O2/c30-25(21-9-3-1-4-10-21)28-24-13-7-8-20(18-24)19-29-16-14-22(15-17-29)26(31)27-23-11-5-2-6-12-23/h7-8,13,18,21-23H,1-6,9-12,14-17,19H2,(H,27,31)(H,28,30)
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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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243542
PNG
(US9428456, 1.157)
Show SMILES Clc1ccc(CN2CCC(CC2)C(=O)NC2CCCCC2)cc1NC(=O)c1ccncn1
Show InChI InChI=1S/C24H30ClN5O2/c25-20-7-6-17(14-22(20)29-24(32)21-8-11-26-16-27-21)15-30-12-9-18(10-13-30)23(31)28-19-4-2-1-3-5-19/h6-8,11,14,16,18-19H,1-5,9-10,12-13,15H2,(H,28,31)(H,29,32)
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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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243546
PNG
(US9428456, 1.161)
Show SMILES Clc1ccc(CN2CCC(CC2)C(=O)NC2CCCCC2)cc1NC(=O)C1CC1c1ccccc1
Show InChI InChI=1S/C29H36ClN3O2/c30-26-12-11-20(17-27(26)32-29(35)25-18-24(25)21-7-3-1-4-8-21)19-33-15-13-22(14-16-33)28(34)31-23-9-5-2-6-10-23/h1,3-4,7-8,11-12,17,22-25H,2,5-6,9-10,13-16,18-19H2,(H,31,34)(H,32,35)
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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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243547
PNG
(US9428456, 1.261)
Show SMILES Cc1nc(CC(=O)Nc2cccc(CN3CCC(CC3)C(=O)NC(C)(C)C)c2)c(C)s1
Show InChI InChI=1S/C24H34N4O2S/c1-16-21(25-17(2)31-16)14-22(29)26-20-8-6-7-18(13-20)15-28-11-9-19(10-12-28)23(30)27-24(3,4)5/h6-8,13,19H,9-12,14-15H2,1-5H3,(H,26,29)(H,27,30)
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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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243570
PNG
(US9428456, 1.284)
Show SMILES FC(F)(F)c1cccc(n1)C(=O)Nc1ccnc(CN2CCC(CC2)C(=O)NC2CCCCC2)n1
Show InChI InChI=1S/C24H29F3N6O2/c25-24(26,27)19-8-4-7-18(30-19)23(35)32-20-9-12-28-21(31-20)15-33-13-10-16(11-14-33)22(34)29-17-5-2-1-3-6-17/h4,7-9,12,16-17H,1-3,5-6,10-11,13-15H2,(H,29,34)(H,28,31,32,35)
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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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243579
PNG
(US9428456, 2.068)
Show SMILES CNC(=O)C1CCN(Cc2cccc(NC(=O)c3cccc(n3)C(F)(F)F)c2)CC1
Show InChI InChI=1S/C21H23F3N4O2/c1-25-19(29)15-8-10-28(11-9-15)13-14-4-2-5-16(12-14)26-20(30)17-6-3-7-18(27-17)21(22,23)24/h2-7,12,15H,8-11,13H2,1H3,(H,25,29)(H,26,30)
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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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243583
PNG
(US9428456, 2.072)
Show SMILES CNC(=O)C1CCN(Cc2cccc(NC(=O)c3cccs3)c2)CC1
Show InChI InChI=1S/C19H23N3O2S/c1-20-18(23)15-7-9-22(10-8-15)13-14-4-2-5-16(12-14)21-19(24)17-6-3-11-25-17/h2-6,11-12,15H,7-10,13H2,1H3,(H,20,23)(H,21,24)
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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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243584
PNG
(US9428456, 2.073)
Show SMILES CN(C)C(=O)C1CCN(Cc2cccc(NC(=O)c3cccs3)c2)CC1
Show InChI InChI=1S/C20H25N3O2S/c1-22(2)20(25)16-8-10-23(11-9-16)14-15-5-3-6-17(13-15)21-19(24)18-7-4-12-26-18/h3-7,12-13,16H,8-11,14H2,1-2H3,(H,21,24)
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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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243586
PNG
(US9428456, 2.075)
Show SMILES O=C(NC1CCCCC1)C1CCN(Cc2cccc(NC(=O)c3cccs3)c2)CC1
Show InChI InChI=1S/C24H31N3O2S/c28-23(25-20-7-2-1-3-8-20)19-11-13-27(14-12-19)17-18-6-4-9-21(16-18)26-24(29)22-10-5-15-30-22/h4-6,9-10,15-16,19-20H,1-3,7-8,11-14,17H2,(H,25,28)(H,26,29)
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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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243605
PNG
(US9428456, 1.336)
Show SMILES CC(C)(C)NC(=O)C1CCN(Cc2cccc(NC(=O)C=C)c2)CC1
Show InChI InChI=1S/C20H29N3O2/c1-5-18(24)21-17-8-6-7-15(13-17)14-23-11-9-16(10-12-23)19(25)22-20(2,3)4/h5-8,13,16H,1,9-12,14H2,2-4H3,(H,21,24)(H,22,25)
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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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243614
PNG
(US9428456, 1.039)
Show SMILES O=C(NC1CCCCC1)C1CCN(Cc2cccc(NC(=O)c3ccccn3)c2)CC1
Show InChI InChI=1S/C25H32N4O2/c30-24(27-21-8-2-1-3-9-21)20-12-15-29(16-13-20)18-19-7-6-10-22(17-19)28-25(31)23-11-4-5-14-26-23/h4-7,10-11,14,17,20-21H,1-3,8-9,12-13,15-16,18H2,(H,27,30)(H,28,31)
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US Patent
n/an/an/an/a 1n/an/an/an/a



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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243629
PNG
(US9428456, 1.054)
Show SMILES Cc1cc(cc(n1)C1CCCC1)C(=O)Nc1cccc(CN2CCC(CC2)C(=O)NC2CCCCC2)c1
Show InChI InChI=1S/C31H42N4O2/c1-22-18-26(20-29(32-22)24-9-5-6-10-24)31(37)34-28-13-7-8-23(19-28)21-35-16-14-25(15-17-35)30(36)33-27-11-3-2-4-12-27/h7-8,13,18-20,24-25,27H,2-6,9-12,14-17,21H2,1H3,(H,33,36)(H,34,37)
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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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243646
PNG
(US9428456, 1.168)
Show SMILES CC(N1CCC(CC1)C(=O)NC1CCCCC1)c1cccc(NC(=O)c2ccc(Cl)cn2)c1
Show InChI InChI=1S/C26H33ClN4O2/c1-18(31-14-12-19(13-15-31)25(32)29-22-7-3-2-4-8-22)20-6-5-9-23(16-20)30-26(33)24-11-10-21(27)17-28-24/h5-6,9-11,16-19,22H,2-4,7-8,12-15H2,1H3,(H,29,32)(H,30,33)
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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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243664
PNG
(US9428456, 1.186)
Show SMILES CC(C)n1ncc2c(cc(C)nc12)C(=O)Nc1cccc(c1)C(C)N1CCC(CC1)C(=O)NC1CCCCC1
Show InChI InChI=1S/C31H42N6O2/c1-20(2)37-29-28(19-32-37)27(17-21(3)33-29)31(39)35-26-12-8-9-24(18-26)22(4)36-15-13-23(14-16-36)30(38)34-25-10-6-5-7-11-25/h8-9,12,17-20,22-23,25H,5-7,10-11,13-16H2,1-4H3,(H,34,38)(H,35,39)
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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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243672
PNG
(US9428456, 1.194)
Show SMILES CC(N1CCC(CC1)C(=O)NC1CCCCC1)c1cccc(NC(=O)c2cnc(s2)N2CCCC2)c1
Show InChI InChI=1S/C28H39N5O2S/c1-20(32-16-12-21(13-17-32)26(34)30-23-9-3-2-4-10-23)22-8-7-11-24(18-22)31-27(35)25-19-29-28(36-25)33-14-5-6-15-33/h7-8,11,18-21,23H,2-6,9-10,12-17H2,1H3,(H,30,34)(H,31,35)
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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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243673
PNG
(US9428456, 1.294)
Show SMILES Cc1cncc(c1)C(=O)Nc1nc(CN2CCC(CC2)C(=O)NC2CCCC2)cs1
Show InChI InChI=1S/C22H29N5O2S/c1-15-10-17(12-23-11-15)21(29)26-22-25-19(14-30-22)13-27-8-6-16(7-9-27)20(28)24-18-4-2-3-5-18/h10-12,14,16,18H,2-9,13H2,1H3,(H,24,28)(H,25,26,29)
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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...


Citation and Details
More data for this
Ligand-Target Pair
C-X-C chemokine receptor type 7 (CXCR7)


(Homo sapiens (Human))
BDBM243715
PNG
(US9428456, 2.094)
Show SMILES CCCNC(=O)C1CCN(Cc2cccc(NC(=O)c3cccc(n3)C(F)(F)F)c2)CC1
Show InChI InChI=1S/C23H27F3N4O2/c1-2-11-27-21(31)17-9-12-30(13-10-17)15-16-5-3-6-18(14-16)28-22(32)19-7-4-8-20(29-19)23(24,25)26/h3-8,14,17H,2,9-13,15H2,1H3,(H,27,31)(H,28,32)
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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...


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