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Compile Data Set for Download or QSAR

Found 103 hits Enz. Inhib. hit(s) with Target = 'C-X-C chemokine receptor type 7'   
Target
(Institution)
LigandTarget
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


(Homo sapiens)
BDBM50092206
PNG
(CHEMBL3581276)
Show SMILES CN1[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc2ccc3ccccc3c2)C(=O)N2CCC[C@H]2C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](CCCNC(N)=N)C1=O
Show InChI InChI=1/C40H53N11O6/c1-50-32(10-5-19-46-40(43)44)35(54)49-31(23-25-12-15-26-7-2-3-8-27(26)21-25)38(57)51-20-6-11-33(51)36(55)48-30(22-24-13-16-28(52)17-14-24)34(53)47-29(37(50)56)9-4-18-45-39(41)42/h2-3,7-8,12-17,21,29-33,52H,4-6,9-11,18-20,22-23H2,1H3,(H,47,53)(H,48,55)(H,49,54)(H4,41,42,45)(H4,43,44,46)/t29-,30+,31-,32-,33-/s2
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n/an/a 800n/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Inhibition of [125I]SDF-1alpha binding to CXCR7 (unknown origin) expressed in CHO cell membranes incubated for 1 hr by radioligand displacement assay


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


(Homo sapiens)
BDBM50434066
PNG
(CHEMBL2381331)
Show SMILES CC1CCCN(CC(O)COc2ccc3c4CCCc4c(=O)oc3c2)C1
Show InChI InChI=1S/C21H27NO4/c1-14-4-3-9-22(11-14)12-15(23)13-25-16-7-8-18-17-5-2-6-19(17)21(24)26-20(18)10-16/h7-8,10,14-15,23H,2-6,9,11-13H2,1H3
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n/an/a 1.29E+3n/an/an/an/an/an/a



PharmaDesign Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]SDF-1alpha from CXCR7 (unknown origin) expressed in CHO cells after 1 hr by TopCount scintillation counting analysis


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


(Homo sapiens)
BDBM50434065
PNG
(CHEMBL1729831)
Show SMILES Cc1cc(OCC(=O)NC2CCN(Cc3ccccc3)CC2)c2c(C)cc(=O)oc2c1
Show InChI InChI=1S/C25H28N2O4/c1-17-12-21(25-18(2)14-24(29)31-22(25)13-17)30-16-23(28)26-20-8-10-27(11-9-20)15-19-6-4-3-5-7-19/h3-7,12-14,20H,8-11,15-16H2,1-2H3,(H,26,28)
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n/an/a 1.49E+3n/an/an/an/an/an/a



PharmaDesign Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]SDF-1alpha from CXCR7 (unknown origin) expressed in CHO cells after 1 hr by TopCount scintillation counting analysis


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


(Homo sapiens)
BDBM50092218
PNG
(CHEMBL3581264)
Show SMILES NC(=N)NCCC[C@@H]1NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](CCCNC(N)=N)NC1=O
Show InChI InChI=1/C39H51N11O6/c40-38(41)44-17-3-8-28-33(52)46-29(9-4-18-45-39(42)43)34(53)49-31(22-24-11-14-25-6-1-2-7-26(25)20-24)37(56)50-19-5-10-32(50)36(55)48-30(35(54)47-28)21-23-12-15-27(51)16-13-23/h1-2,6-7,11-16,20,28-32,51H,3-5,8-10,17-19,21-22H2,(H,46,52)(H,47,54)(H,48,55)(H,49,53)(H4,40,41,44)(H4,42,43,45)/t28-,29-,30+,31-,32-/s2
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n/an/a 1.50E+3n/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Inhibition of [125I]SDF-1alpha binding to CXCR7 (unknown origin) expressed in CHO cell membranes incubated for 1 hr by radioligand displacement assay


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


(Homo sapiens)
BDBM50092260
PNG
(CHEMBL3581286)
Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@@H](NC(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](CCCNC(N)=N)NC1=O)[C@@H](C)O
Show InChI InChI=1/C40H60N12O7/c1-4-22(2)31-36(57)48-28(13-8-18-46-40(43)44)33(54)47-27(12-7-17-45-39(41)42)34(55)49-29(21-24-15-16-25-10-5-6-11-26(25)20-24)38(59)52-19-9-14-30(52)35(56)51-32(23(3)53)37(58)50-31/h5-6,10-11,15-16,20,22-23,27-32,53H,4,7-9,12-14,17-19,21H2,1-3H3,(H,47,54)(H,48,57)(H,49,55)(H,50,58)(H,51,56)(H4,41,42,45)(H4,43,44,46)/t22-,23+,27-,28+,29-,30+,31-,32-/s2
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n/an/a 1.70E+3n/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Inhibition of [125I]SDF-1alpha binding to CXCR7 (unknown origin) expressed in CHO cell membranes incubated for 1 hr by radioligand displacement assay


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


(Homo sapiens)
BDBM50434064
PNG
(CHEMBL2381332)
Show SMILES COc1ccccc1C(CNC(=O)c1cc(on1)-c1ccc(Br)cc1)N1CCC(C)CC1
Show InChI InChI=1S/C25H28BrN3O3/c1-17-11-13-29(14-12-17)22(20-5-3-4-6-23(20)31-2)16-27-25(30)21-15-24(32-28-21)18-7-9-19(26)10-8-18/h3-10,15,17,22H,11-14,16H2,1-2H3,(H,27,30)
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n/an/a 1.87E+3n/an/an/an/an/an/a



PharmaDesign Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]SDF-1alpha from CXCR7 (unknown origin) expressed in CHO cells after 1 hr by TopCount scintillation counting analysis


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


(Homo sapiens)
BDBM50434063
PNG
(CHEMBL2381333)
Show SMILES CCC1CCCCN1CCCNC(=O)CSc1cc(=O)n(C)c2ccc(Cl)cc12
Show InChI InChI=1S/C22H30ClN3O2S/c1-3-17-7-4-5-11-26(17)12-6-10-24-21(27)15-29-20-14-22(28)25(2)19-9-8-16(23)13-18(19)20/h8-9,13-14,17H,3-7,10-12,15H2,1-2H3,(H,24,27)
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n/an/a 2.16E+3n/an/an/an/an/an/a



PharmaDesign Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]SDF-1alpha from CXCR7 (unknown origin) expressed in CHO cells after 1 hr by TopCount scintillation counting analysis


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


(Homo sapiens)
BDBM50434062
PNG
(CHEMBL1570388)
Show SMILES CN(CCCNC(=O)c1cc2c(s1)c1ccccc1n(C)c2=O)Cc1ccccc1
Show InChI InChI=1S/C24H25N3O2S/c1-26(16-17-9-4-3-5-10-17)14-8-13-25-23(28)21-15-19-22(30-21)18-11-6-7-12-20(18)27(2)24(19)29/h3-7,9-12,15H,8,13-14,16H2,1-2H3,(H,25,28)
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n/an/a 2.21E+3n/an/an/an/an/an/a



PharmaDesign Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]SDF-1alpha from CXCR7 (unknown origin) expressed in CHO cells after 1 hr by TopCount scintillation counting analysis


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


(Homo sapiens)
BDBM50092207
PNG
(CHEMBL3581275)
Show SMILES CN1[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc2ccc3ccccc3c2)C(=O)N2CCC[C@H]2C(=O)N[C@H](Cc2ccc(O)cc2)C1=O
Show InChI InChI=1/C40H53N11O6/c1-50-32(10-5-19-46-40(43)44)35(54)47-29(9-4-18-45-39(41)42)34(53)48-31(23-25-12-15-26-7-2-3-8-27(26)21-25)38(57)51-20-6-11-33(51)36(55)49-30(37(50)56)22-24-13-16-28(52)17-14-24/h2-3,7-8,12-17,21,29-33,52H,4-6,9-11,18-20,22-23H2,1H3,(H,47,54)(H,48,53)(H,49,55)(H4,41,42,45)(H4,43,44,46)/t29-,30+,31-,32-,33-/s2
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n/an/a 2.40E+3n/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Inhibition of [125I]SDF-1alpha binding to CXCR7 (unknown origin) expressed in CHO cell membranes incubated for 1 hr by radioligand displacement assay


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


(Homo sapiens)
BDBM50434061
PNG
(CHEMBL2381334)
Show SMILES CC1CCCCN1CCNC(=O)c1noc-2c1COc1ccc(C)cc-21
Show InChI InChI=1S/C20H25N3O3/c1-13-6-7-17-15(11-13)19-16(12-25-17)18(22-26-19)20(24)21-8-10-23-9-4-3-5-14(23)2/h6-7,11,14H,3-5,8-10,12H2,1-2H3,(H,21,24)
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n/an/a 2.64E+3n/an/an/an/an/an/a



PharmaDesign Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]SDF-1alpha from CXCR7 (unknown origin) expressed in CHO cells after 1 hr by TopCount scintillation counting analysis


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


(Homo sapiens)
BDBM50434060
PNG
(CHEMBL1430708)
Show SMILES CCC(C(=O)NCCCN(CC)Cc1ccccc1)n1nc(C)c2sc3ccccc3c2c1=O
Show InChI InChI=1S/C27H32N4O2S/c1-4-22(26(32)28-16-11-17-30(5-2)18-20-12-7-6-8-13-20)31-27(33)24-21-14-9-10-15-23(21)34-25(24)19(3)29-31/h6-10,12-15,22H,4-5,11,16-18H2,1-3H3,(H,28,32)
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n/an/a 2.78E+3n/an/an/an/an/an/a



PharmaDesign Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]SDF-1alpha from CXCR7 (unknown origin) expressed in CHO cells after 1 hr by TopCount scintillation counting analysis


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


(Homo sapiens)
BDBM50434059
PNG
(CHEMBL2381335)
Show SMILES CC1CC(C)CN(CCCNC(=O)c2noc-3c2COc2ccc(C)cc-32)C1
Show InChI InChI=1S/C22H29N3O3/c1-14-5-6-19-17(10-14)21-18(13-27-19)20(24-28-21)22(26)23-7-4-8-25-11-15(2)9-16(3)12-25/h5-6,10,15-16H,4,7-9,11-13H2,1-3H3,(H,23,26)
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n/an/a 2.92E+3n/an/an/an/an/an/a



PharmaDesign Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]SDF-1alpha from CXCR7 (unknown origin) expressed in CHO cells after 1 hr by TopCount scintillation counting analysis


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


(Homo sapiens)
BDBM50434058
PNG
(CHEMBL2381336)
Show SMILES O=C(N1CCC(CC1)N1CCCCC1)c1ccc(s1)N1CCc2ccccc12
Show InChI InChI=1S/C23H29N3OS/c27-23(25-15-11-19(12-16-25)24-13-4-1-5-14-24)21-8-9-22(28-21)26-17-10-18-6-2-3-7-20(18)26/h2-3,6-9,19H,1,4-5,10-17H2
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n/an/a 3.20E+3n/an/an/an/an/an/a



PharmaDesign Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]SDF-1alpha from CXCR7 (unknown origin) expressed in CHO cells after 1 hr by TopCount scintillation counting analysis


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


(Homo sapiens)
BDBM50092205
PNG
(CHEMBL3581277)
Show SMILES CN1[C@@H](Cc2ccc3ccccc3c2)C(=O)N2CCC[C@H]2C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C1=O
Show InChI InChI=1/C40H53N11O6/c1-50-33(23-25-12-15-26-7-2-3-8-27(26)21-25)38(57)51-20-6-11-32(51)36(55)49-31(22-24-13-16-28(52)17-14-24)35(54)47-29(9-4-18-45-39(41)42)34(53)48-30(37(50)56)10-5-19-46-40(43)44/h2-3,7-8,12-17,21,29-33,52H,4-6,9-11,18-20,22-23H2,1H3,(H,47,54)(H,48,53)(H,49,55)(H4,41,42,45)(H4,43,44,46)/t29-,30-,31+,32-,33-/s2
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n/an/a 3.40E+3n/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Inhibition of [125I]SDF-1alpha binding to CXCR7 (unknown origin) expressed in CHO cell membranes incubated for 1 hr by radioligand displacement assay


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


(Homo sapiens)
BDBM50434057
PNG
(CHEMBL2381337)
Show SMILES CCCCN(CC)CCNC(=O)c1ccc(s1)N1CCc2ccccc12
Show InChI InChI=1S/C21H29N3OS/c1-3-5-14-23(4-2)16-13-22-21(25)19-10-11-20(26-19)24-15-12-17-8-6-7-9-18(17)24/h6-11H,3-5,12-16H2,1-2H3,(H,22,25)
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n/an/a 3.89E+3n/an/an/an/an/an/a



PharmaDesign Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]SDF-1alpha from CXCR7 (unknown origin) expressed in CHO cells after 1 hr by TopCount scintillation counting analysis


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


(Homo sapiens)
BDBM50434056
PNG
(CHEMBL2381338)
Show SMILES Cc1ccc(cc1)C(=O)Nc1ncc(CN2CCC(C2)c2ccccc2)s1
Show InChI InChI=1S/C22H23N3OS/c1-16-7-9-18(10-8-16)21(26)24-22-23-13-20(27-22)15-25-12-11-19(14-25)17-5-3-2-4-6-17/h2-10,13,19H,11-12,14-15H2,1H3,(H,23,24,26)
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n/an/a 4.35E+3n/an/an/an/an/an/a



PharmaDesign Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]SDF-1alpha from CXCR7 (unknown origin) expressed in CHO cells after 1 hr by TopCount scintillation counting analysis


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


(Homo sapiens)
BDBM50092202
PNG
(CHEMBL3581280)
Show SMILES CN1[C@H](CCCNC(N)=N)C(=O)N[C@@H](Cc2ccc3ccccc3c2)C(=O)N2CCC[C@H]2C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](CCCNC(N)=N)C1=O
Show InChI InChI=1/C40H53N11O6/c1-50-32(10-5-19-46-40(43)44)35(54)49-31(23-25-12-15-26-7-2-3-8-27(26)21-25)38(57)51-20-6-11-33(51)36(55)48-30(22-24-13-16-28(52)17-14-24)34(53)47-29(37(50)56)9-4-18-45-39(41)42/h2-3,7-8,12-17,21,29-33,52H,4-6,9-11,18-20,22-23H2,1H3,(H,47,53)(H,48,55)(H,49,54)(H4,41,42,45)(H4,43,44,46)/t29-,30+,31-,32+,33-/s2
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n/an/a 4.60E+3n/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Inhibition of [125I]SDF-1alpha binding to CXCR7 (unknown origin) expressed in CHO cell membranes incubated for 1 hr by radioligand displacement assay


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


(Homo sapiens)
BDBM50092211
PNG
(CHEMBL3581271)
Show SMILES NC(=N)NCCC[C@H]1NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](CCCNC(N)=N)NC1=O
Show InChI InChI=1/C39H51N11O6/c40-38(41)44-17-3-8-28-33(52)46-29(9-4-18-45-39(42)43)34(53)49-31(22-24-11-14-25-6-1-2-7-26(25)20-24)37(56)50-19-5-10-32(50)36(55)48-30(35(54)47-28)21-23-12-15-27(51)16-13-23/h1-2,6-7,11-16,20,28-32,51H,3-5,8-10,17-19,21-22H2,(H,46,52)(H,47,54)(H,48,55)(H,49,53)(H4,40,41,44)(H4,42,43,45)/t28-,29+,30-,31+,32+/s2
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n/an/a 4.60E+3n/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Inhibition of [125I]SDF-1alpha binding to CXCR7 (unknown origin) expressed in CHO cell membranes incubated for 1 hr by radioligand displacement assay


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


(Homo sapiens)
BDBM50434067
PNG
(CHEMBL2381330)
Show SMILES CCc1ccc(NC(=O)CSc2nc3ccccc3c(=O)n2CCCC(=O)NCN2CCOCC2)cc1
Show InChI InChI=1S/C27H33N5O4S/c1-2-20-9-11-21(12-10-20)29-25(34)18-37-27-30-23-7-4-3-6-22(23)26(35)32(27)13-5-8-24(33)28-19-31-14-16-36-17-15-31/h3-4,6-7,9-12H,2,5,8,13-19H2,1H3,(H,28,33)(H,29,34)
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n/an/a 4.74E+3n/an/an/an/an/an/a



PharmaDesign Inc.

Curated by ChEMBL


Assay Description
Binding affinity to CXCR7 (unknown origin)


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


(Homo sapiens)
BDBM50434055
PNG
(CHEMBL2381215)
Show SMILES CC1CCCCN1CCNC(=O)c1cc2CSc3cc(Cl)ccc3-c2s1
Show InChI InChI=1S/C20H23ClN2OS2/c1-13-4-2-3-8-23(13)9-7-22-20(24)18-10-14-12-25-17-11-15(21)5-6-16(17)19(14)26-18/h5-6,10-11,13H,2-4,7-9,12H2,1H3,(H,22,24)
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n/an/a 5.27E+3n/an/an/an/an/an/a



PharmaDesign Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]SDF-1alpha from CXCR7 (unknown origin) expressed in CHO cells after 1 hr by TopCount scintillation counting analysis


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


(Homo sapiens)
BDBM50434054
PNG
(CHEMBL2381216)
Show SMILES CN(C)c1ccc(\C=C2/SC(=NC2=O)N2CCN(CCO)CC2)cc1
Show InChI InChI=1S/C18H24N4O2S/c1-20(2)15-5-3-14(4-6-15)13-16-17(24)19-18(25-16)22-9-7-21(8-10-22)11-12-23/h3-6,13,23H,7-12H2,1-2H3/b16-13-
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n/an/a 5.36E+3n/an/an/an/an/an/a



PharmaDesign Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]SDF-1alpha from CXCR7 (unknown origin) expressed in CHO cells after 1 hr by TopCount scintillation counting analysis


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


(Homo sapiens)
BDBM50434053
PNG
(CHEMBL2381217)
Show SMILES CN(Cc1ccccc1NC(=O)\C=C\c1cnn(c1)-c1ccccc1)C1CCCCC1
Show InChI InChI=1S/C26H30N4O/c1-29(23-11-4-2-5-12-23)20-22-10-8-9-15-25(22)28-26(31)17-16-21-18-27-30(19-21)24-13-6-3-7-14-24/h3,6-10,13-19,23H,2,4-5,11-12,20H2,1H3,(H,28,31)/b17-16+
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n/an/a 5.84E+3n/an/an/an/an/an/a



PharmaDesign Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]SDF-1alpha from CXCR7 (unknown origin) expressed in CHO cells after 1 hr by TopCount scintillation counting analysis


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


(Homo sapiens)
BDBM50434052
PNG
(CHEMBL2381218)
Show SMILES CCN1CCCC1CNC(=O)CN1C(=O)\C(Sc2ccccc12)=C\c1ccccc1F
Show InChI InChI=1S/C24H26FN3O2S/c1-2-27-13-7-9-18(27)15-26-23(29)16-28-20-11-5-6-12-21(20)31-22(24(28)30)14-17-8-3-4-10-19(17)25/h3-6,8,10-12,14,18H,2,7,9,13,15-16H2,1H3,(H,26,29)/b22-14-
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n/an/a 6.19E+3n/an/an/an/an/an/a



PharmaDesign Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]SDF-1alpha from CXCR7 (unknown origin) expressed in CHO cells after 1 hr by TopCount scintillation counting analysis


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


(Homo sapiens)
BDBM50434068
PNG
(CHEMBL2381327)
Show SMILES Clc1ccc2-c3sc(cc3CSc2c1)C(=O)N1CCC(CC1)N1CCCCC1
Show InChI InChI=1S/C22H25ClN2OS2/c23-16-4-5-18-19(13-16)27-14-15-12-20(28-21(15)18)22(26)25-10-6-17(7-11-25)24-8-2-1-3-9-24/h4-5,12-13,17H,1-3,6-11,14H2
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n/an/a 6.33E+3n/an/an/an/an/an/a



PharmaDesign Inc.

Curated by ChEMBL


Assay Description
Binding affinity to CXCR7 (unknown origin)


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


(Homo sapiens)
BDBM50434051
PNG
(CHEMBL2381219)
Show SMILES CCN1CCCC1CNC(=O)c1ccc(s1)-n1ccc2ccccc12
Show InChI InChI=1S/C20H23N3OS/c1-2-22-12-5-7-16(22)14-21-20(24)18-9-10-19(25-18)23-13-11-15-6-3-4-8-17(15)23/h3-4,6,8-11,13,16H,2,5,7,12,14H2,1H3,(H,21,24)
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n/an/a 6.75E+3n/an/an/an/an/an/a



PharmaDesign Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]SDF-1alpha from CXCR7 (unknown origin) expressed in CHO cells after 1 hr by TopCount scintillation counting analysis


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


(Homo sapiens)
BDBM50434050
PNG
(CHEMBL2381220)
Show SMILES Cc1ccc2[nH]c(=O)c3cc(sc3c2c1)C(=O)NCCN1CCCCCC1
Show InChI InChI=1S/C21H25N3O2S/c1-14-6-7-17-15(12-14)19-16(20(25)23-17)13-18(27-19)21(26)22-8-11-24-9-4-2-3-5-10-24/h6-7,12-13H,2-5,8-11H2,1H3,(H,22,26)(H,23,25)
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n/an/a 7.00E+3n/an/an/an/an/an/a



PharmaDesign Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]SDF-1alpha from CXCR7 (unknown origin) expressed in CHO cells after 1 hr by TopCount scintillation counting analysis


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


(Homo sapiens)
BDBM50434049
PNG
(CHEMBL2381324)
Show SMILES CC1CCCCN1CC(O)COc1ccc2c3CCCc3c(=O)oc2c1
Show InChI InChI=1S/C21H27NO4/c1-14-5-2-3-10-22(14)12-15(23)13-25-16-8-9-18-17-6-4-7-19(17)21(24)26-20(18)11-16/h8-9,11,14-15,23H,2-7,10,12-13H2,1H3
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n/an/a 8.02E+3n/an/an/an/an/an/a



PharmaDesign Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]SDF-1alpha from CXCR7 (unknown origin) expressed in CHO cells after 1 hr by TopCount scintillation counting analysis


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


(Homo sapiens)
BDBM50434048
PNG
(CHEMBL2381325)
Show SMILES CCOc1cc(NC(=O)c2ccc(C)cc2)c(OCC)cc1NC(=S)NCCCN(C)C
Show InChI InChI=1S/C24H34N4O3S/c1-6-30-21-16-20(27-24(32)25-13-8-14-28(4)5)22(31-7-2)15-19(21)26-23(29)18-11-9-17(3)10-12-18/h9-12,15-16H,6-8,13-14H2,1-5H3,(H,26,29)(H2,25,27,32)
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n/an/a 9.79E+3n/an/an/an/an/an/a



PharmaDesign Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]SDF-1alpha from CXCR7 (unknown origin) expressed in CHO cells after 1 hr by TopCount scintillation counting analysis


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


(Homo sapiens)
BDBM50434047
PNG
(CHEMBL1407777)
Show SMILES CCN1CCc2nc3sc(C(=O)N4CCc5ccccc5C4)c(N)c3cc2C1
Show InChI InChI=1S/C22H24N4OS/c1-2-25-9-8-18-16(12-25)11-17-19(23)20(28-21(17)24-18)22(27)26-10-7-14-5-3-4-6-15(14)13-26/h3-6,11H,2,7-10,12-13,23H2,1H3
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n/an/a 1.00E+4n/an/an/an/an/an/a



PharmaDesign Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]SDF-1alpha from CXCR7 (unknown origin) expressed in CHO cells after 1 hr by TopCount scintillation counting analysis


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


(Homo sapiens)
BDBM50092223
PNG
(CHEMBL3581284)
Show SMILES C[C@@H]1N(C)C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccc3ccccc3c2)NC1=O
Show InChI InChI=1/C37H46N8O6/c1-22-32(47)43-30(21-24-11-14-25-7-3-4-8-26(25)19-24)36(51)45-18-6-10-31(45)34(49)42-29(20-23-12-15-27(46)16-13-23)33(48)41-28(35(50)44(22)2)9-5-17-40-37(38)39/h3-4,7-8,11-16,19,22,28-31,46H,5-6,9-10,17-18,20-21H2,1-2H3,(H,41,48)(H,42,49)(H,43,47)(H4,38,39,40)/t22-,28-,29+,30-,31-/s2
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n/an/a 1.10E+4n/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Inhibition of [125I]SDF-1alpha binding to CXCR7 (unknown origin) expressed in CHO cell membranes incubated for 1 hr by radioligand displacement assay


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


(Homo sapiens)
BDBM50434046
PNG
(CHEMBL2381326)
Show SMILES O=C(NCCCN(Cc1ccco1)C1CCCC1)c1cc2CSc3ccccc3-c2s1
Show InChI InChI=1S/C25H28N2O2S2/c28-25(23-15-18-17-30-22-11-4-3-10-21(22)24(18)31-23)26-12-6-13-27(19-7-1-2-8-19)16-20-9-5-14-29-20/h3-5,9-11,14-15,19H,1-2,6-8,12-13,16-17H2,(H,26,28)
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n/an/a 1.14E+4n/an/an/an/an/an/a



PharmaDesign Inc.

Curated by ChEMBL


Assay Description
Displacement of [125I]SDF-1alpha from CXCR7 (unknown origin) expressed in CHO cells after 1 hr by TopCount scintillation counting analysis


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


(Homo sapiens)
BDBM50092216
PNG
(CHEMBL3581266)
Show SMILES NC(=N)NCCC[C@@H]1NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)[C@@H]2CCCCN2C(=O)[C@H](Cc2ccc3ccccc3c2)NC1=O
Show InChI InChI=1/C40H53N11O6/c41-39(42)45-18-5-9-29-34(53)47-30(10-6-19-46-40(43)44)35(54)50-32(23-25-12-15-26-7-1-2-8-27(26)21-25)38(57)51-20-4-3-11-33(51)37(56)49-31(36(55)48-29)22-24-13-16-28(52)17-14-24/h1-2,7-8,12-17,21,29-33,52H,3-6,9-11,18-20,22-23H2,(H,47,53)(H,48,55)(H,49,56)(H,50,54)(H4,41,42,45)(H4,43,44,46)/t29-,30-,31+,32-,33-/s2
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n/an/a 1.30E+4n/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Inhibition of [125I]SDF-1alpha binding to CXCR7 (unknown origin) expressed in CHO cell membranes incubated for 1 hr by radioligand displacement assay


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


(Homo sapiens)
BDBM50092203
PNG
(CHEMBL3581279)
Show SMILES CN1[C@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc2ccc3ccccc3c2)C(=O)N2CCC[C@H]2C(=O)N[C@H](Cc2ccc(O)cc2)C1=O
Show InChI InChI=1/C40H53N11O6/c1-50-32(10-5-19-46-40(43)44)35(54)47-29(9-4-18-45-39(41)42)34(53)48-31(23-25-12-15-26-7-2-3-8-27(26)21-25)38(57)51-20-6-11-33(51)36(55)49-30(37(50)56)22-24-13-16-28(52)17-14-24/h2-3,7-8,12-17,21,29-33,52H,4-6,9-11,18-20,22-23H2,1H3,(H,47,54)(H,48,53)(H,49,55)(H4,41,42,45)(H4,43,44,46)/t29-,30+,31-,32+,33-/s2
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n/an/a 1.30E+4n/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Inhibition of [125I]SDF-1alpha binding to CXCR7 (unknown origin) expressed in CHO cell membranes incubated for 1 hr by radioligand displacement assay


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


(Homo sapiens)
BDBM50092214
PNG
(CHEMBL3581268)
Show SMILES C[C@@H]1N(C)C(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccc(O)cc2)NC1=O
Show InChI InChI=1/C38H51N11O6/c1-22-32(51)47-30(20-23-12-15-27(50)16-13-23)35(54)46-28(9-5-17-43-37(39)40)33(52)45-29(10-6-18-44-38(41)42)34(53)48-31(36(55)49(22)2)21-24-11-14-25-7-3-4-8-26(25)19-24/h3-4,7-8,11-16,19,22,28-31,50H,5-6,9-10,17-18,20-21H2,1-2H3,(H,45,52)(H,46,54)(H,47,51)(H,48,53)(H4,39,40,43)(H4,41,42,44)/t22-,28-,29-,30+,31-/s2
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n/an/a 1.50E+4n/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Inhibition of [125I]SDF-1alpha binding to CXCR7 (unknown origin) expressed in CHO cell membranes incubated for 1 hr by radioligand displacement assay


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


(Homo sapiens)
BDBM50092222
PNG
(CHEMBL3581283)
Show SMILES C[C@@H]1NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](CCCNC(N)=N)N(C)C1=O
Show InChI InChI=1/C37H46N8O6/c1-22-35(50)44(2)30(9-5-17-40-37(38)39)33(48)43-29(21-24-11-14-25-7-3-4-8-26(25)19-24)36(51)45-18-6-10-31(45)34(49)42-28(32(47)41-22)20-23-12-15-27(46)16-13-23/h3-4,7-8,11-16,19,22,28-31,46H,5-6,9-10,17-18,20-21H2,1-2H3,(H,41,47)(H,42,49)(H,43,48)(H4,38,39,40)/t22-,28+,29-,30-,31-/s2
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n/an/a 1.60E+4n/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Inhibition of [125I]SDF-1alpha binding to CXCR7 (unknown origin) expressed in CHO cell membranes incubated for 1 hr by radioligand displacement assay


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


(Homo sapiens)
BDBM50092221
PNG
(CHEMBL3581261)
Show SMILES C[C@@H]1NC(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccc(O)cc2)NC1=O
Show InChI InChI=1/C37H49N11O6/c1-21-31(50)47-29(19-22-11-14-26(49)15-12-22)35(54)46-27(8-4-16-42-36(38)39)32(51)45-28(9-5-17-43-37(40)41)33(52)48-30(34(53)44-21)20-23-10-13-24-6-2-3-7-25(24)18-23/h2-3,6-7,10-15,18,21,27-30,49H,4-5,8-9,16-17,19-20H2,1H3,(H,44,53)(H,45,51)(H,46,54)(H,47,50)(H,48,52)(H4,38,39,42)(H4,40,41,43)/t21-,27-,28-,29+,30-/s2
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n/an/a 1.80E+4n/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Inhibition of [125I]SDF-1alpha binding to CXCR7 (unknown origin) expressed in CHO cell membranes incubated for 1 hr by radioligand displacement assay


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


(Homo sapiens)
BDBM50092208
PNG
(CHEMBL3581274)
Show SMILES CN1[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc2ccc3ccccc3c2)C(=O)N2CCC[C@H]2C1=O
Show InChI InChI=1/C40H53N11O6/c1-50-33(23-24-13-16-28(52)17-14-24)36(55)48-30(10-5-19-46-40(43)44)34(53)47-29(9-4-18-45-39(41)42)35(54)49-31(37(56)51-20-6-11-32(51)38(50)57)22-25-12-15-26-7-2-3-8-27(26)21-25/h2-3,7-8,12-17,21,29-33,52H,4-6,9-11,18-20,22-23H2,1H3,(H,47,53)(H,48,55)(H,49,54)(H4,41,42,45)(H4,43,44,46)/t29-,30-,31-,32-,33+/s2
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n/an/a 1.80E+4n/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Inhibition of [125I]SDF-1alpha binding to CXCR7 (unknown origin) expressed in CHO cell membranes incubated for 1 hr by radioligand displacement assay


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


(Homo sapiens)
BDBM50092204
PNG
(CHEMBL3581278)
Show SMILES CN1[C@@H](Cc2ccc(O)cc2)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc2ccc3ccccc3c2)C(=O)N2CCC[C@H]2C1=O
Show InChI InChI=1/C40H53N11O6/c1-50-33(23-24-13-16-28(52)17-14-24)36(55)48-30(10-5-19-46-40(43)44)34(53)47-29(9-4-18-45-39(41)42)35(54)49-31(37(56)51-20-6-11-32(51)38(50)57)22-25-12-15-26-7-2-3-8-27(26)21-25/h2-3,7-8,12-17,21,29-33,52H,4-6,9-11,18-20,22-23H2,1H3,(H,47,53)(H,48,55)(H,49,54)(H4,41,42,45)(H4,43,44,46)/t29-,30-,31-,32-,33-/s2
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n/an/a 2.30E+4n/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Inhibition of [125I]SDF-1alpha binding to CXCR7 (unknown origin) expressed in CHO cell membranes incubated for 1 hr by radioligand displacement assay


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


(Homo sapiens)
BDBM50166106
PNG
(CHEMBL436283 | N-{3-[(2S,5S,8S,14R)-5-(3-Guanidino...)
Show SMILES NC(N)=NCCC[C@@H]1NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)CNC(=O)[C@H](Cc2ccc3ccccc3c2)NC1=O
Show InChI InChI=1S/C36H47N11O6/c37-35(38)41-15-3-7-26-32(51)45-27(8-4-16-42-36(39)40)33(52)47-28(19-22-9-12-23-5-1-2-6-24(23)17-22)31(50)43-20-30(49)44-29(34(53)46-26)18-21-10-13-25(48)14-11-21/h1-2,5-6,9-14,17,26-29,48H,3-4,7-8,15-16,18-20H2,(H,43,50)(H,44,49)(H,45,51)(H,46,53)(H,47,52)(H4,37,38,41)(H4,39,40,42)/t26-,27-,28-,29+/m0/s1
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n/an/a>3.00E+4n/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Inhibition of [125I]SDF-1alpha binding to CXCR7 (unknown origin) expressed in CHO cell membranes incubated for 1 hr by radioligand displacement assay


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


(Homo sapiens)
BDBM50092220
PNG
(CHEMBL3581262)
Show SMILES C[C@H]1NC(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccc(O)cc2)NC1=O
Show InChI InChI=1/C37H49N11O6/c1-21-31(50)47-29(19-22-11-14-26(49)15-12-22)35(54)46-27(8-4-16-42-36(38)39)32(51)45-28(9-5-17-43-37(40)41)33(52)48-30(34(53)44-21)20-23-10-13-24-6-2-3-7-25(24)18-23/h2-3,6-7,10-15,18,21,27-30,49H,4-5,8-9,16-17,19-20H2,1H3,(H,44,53)(H,45,51)(H,46,54)(H,47,50)(H,48,52)(H4,38,39,42)(H4,40,41,43)/t21-,27+,28+,29-,30+/s2
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n/an/a>3.00E+4n/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Inhibition of [125I]SDF-1alpha binding to CXCR7 (unknown origin) expressed in CHO cell membranes incubated for 1 hr by radioligand displacement assay


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


(Homo sapiens)
BDBM50092219
PNG
(CHEMBL3581263)
Show SMILES NC(=N)NCCC[C@@H]1NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)CCNC(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](CCCNC(N)=N)NC1=O
Show InChI InChI=1/C37H49N11O6/c38-36(39)43-16-3-7-27-33(52)46-28(8-4-17-44-37(40)41)34(53)48-29(21-23-9-12-24-5-1-2-6-25(24)19-23)32(51)42-18-15-31(50)45-30(35(54)47-27)20-22-10-13-26(49)14-11-22/h1-2,5-6,9-14,19,27-30,49H,3-4,7-8,15-18,20-21H2,(H,42,51)(H,45,50)(H,46,52)(H,47,54)(H,48,53)(H4,38,39,43)(H4,40,41,44)/t27-,28-,29-,30+/s2
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n/an/a>3.00E+4n/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Inhibition of [125I]SDF-1alpha binding to CXCR7 (unknown origin) expressed in CHO cell membranes incubated for 1 hr by radioligand displacement assay


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


(Homo sapiens)
BDBM50092217
PNG
(CHEMBL3581265)
Show SMILES NC(=N)NCCC[C@@H]1NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)[C@H]2CCCN2C(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](CCCNC(N)=N)NC1=O
Show InChI InChI=1/C39H51N11O6/c40-38(41)44-17-3-8-28-33(52)46-29(9-4-18-45-39(42)43)34(53)49-31(22-24-11-14-25-6-1-2-7-26(25)20-24)37(56)50-19-5-10-32(50)36(55)48-30(35(54)47-28)21-23-12-15-27(51)16-13-23/h1-2,6-7,11-16,20,28-32,51H,3-5,8-10,17-19,21-22H2,(H,46,52)(H,47,54)(H,48,55)(H,49,53)(H4,40,41,44)(H4,42,43,45)/t28-,29-,30+,31-,32+/s2
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n/an/a>3.00E+4n/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Inhibition of [125I]SDF-1alpha binding to CXCR7 (unknown origin) expressed in CHO cell membranes incubated for 1 hr by radioligand displacement assay


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


(Homo sapiens)
BDBM50092215
PNG
(CHEMBL3581267)
Show SMILES NC(=N)NCCC[C@@H]1NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)[C@H]2CCCCN2C(=O)[C@H](Cc2ccc3ccccc3c2)NC1=O
Show InChI InChI=1/C40H53N11O6/c41-39(42)45-18-5-9-29-34(53)47-30(10-6-19-46-40(43)44)35(54)50-32(23-25-12-15-26-7-1-2-8-27(26)21-25)38(57)51-20-4-3-11-33(51)37(56)49-31(36(55)48-29)22-24-13-16-28(52)17-14-24/h1-2,7-8,12-17,21,29-33,52H,3-6,9-11,18-20,22-23H2,(H,47,53)(H,48,55)(H,49,56)(H,50,54)(H4,41,42,45)(H4,43,44,46)/t29-,30-,31+,32-,33+/s2
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n/an/a>3.00E+4n/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Inhibition of [125I]SDF-1alpha binding to CXCR7 (unknown origin) expressed in CHO cell membranes incubated for 1 hr by radioligand displacement assay


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


(Homo sapiens)
BDBM50092213
PNG
(CHEMBL3581269)
Show SMILES C[C@H]1N(C)C(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccc(O)cc2)NC1=O
Show InChI InChI=1/C38H51N11O6/c1-22-32(51)47-30(20-23-12-15-27(50)16-13-23)35(54)46-28(9-5-17-43-37(39)40)33(52)45-29(10-6-18-44-38(41)42)34(53)48-31(36(55)49(22)2)21-24-11-14-25-7-3-4-8-26(25)19-24/h3-4,7-8,11-16,19,22,28-31,50H,5-6,9-10,17-18,20-21H2,1-2H3,(H,45,52)(H,46,54)(H,47,51)(H,48,53)(H4,39,40,43)(H4,41,42,44)/t22-,28+,29+,30-,31+/s2
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n/an/a>3.00E+4n/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Inhibition of [125I]SDF-1alpha binding to CXCR7 (unknown origin) expressed in CHO cell membranes incubated for 1 hr by radioligand displacement assay


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


(Homo sapiens)
BDBM50092212
PNG
(CHEMBL3581270)
Show SMILES NC(=N)NCCC[C@@H]1NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](CCCNC(N)=N)NC1=O
Show InChI InChI=1/C39H51N11O6/c40-38(41)44-17-3-8-28-33(52)46-29(9-4-18-45-39(42)43)34(53)49-31(22-24-11-14-25-6-1-2-7-26(25)20-24)37(56)50-19-5-10-32(50)36(55)48-30(35(54)47-28)21-23-12-15-27(51)16-13-23/h1-2,6-7,11-16,20,28-32,51H,3-5,8-10,17-19,21-22H2,(H,46,52)(H,47,54)(H,48,55)(H,49,53)(H4,40,41,44)(H4,42,43,45)/t28-,29-,30-,31-,32-/s2
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n/an/a>3.00E+4n/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Inhibition of [125I]SDF-1alpha binding to CXCR7 (unknown origin) expressed in CHO cell membranes incubated for 1 hr by radioligand displacement assay


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


(Homo sapiens)
BDBM50092210
PNG
(CHEMBL3581272)
Show SMILES NC(=N)NCCC[C@@H]1NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@@H](CCCNC(N)=N)NC1=O
Show InChI InChI=1/C39H51N11O6/c40-38(41)44-17-3-8-28-33(52)46-29(9-4-18-45-39(42)43)34(53)49-31(22-24-11-14-25-6-1-2-7-26(25)20-24)37(56)50-19-5-10-32(50)36(55)48-30(35(54)47-28)21-23-12-15-27(51)16-13-23/h1-2,6-7,11-16,20,28-32,51H,3-5,8-10,17-19,21-22H2,(H,46,52)(H,47,54)(H,48,55)(H,49,53)(H4,40,41,44)(H4,42,43,45)/t28-,29+,30+,31-,32-/s2
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n/an/a>3.00E+4n/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Inhibition of [125I]SDF-1alpha binding to CXCR7 (unknown origin) expressed in CHO cell membranes incubated for 1 hr by radioligand displacement assay


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


(Homo sapiens)
BDBM50092209
PNG
(CHEMBL3581273)
Show SMILES NC(=N)NCCC[C@@H]1NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](CCCNC(N)=N)NC1=O
Show InChI InChI=1/C39H51N11O6/c40-38(41)44-17-3-8-28-33(52)46-29(9-4-18-45-39(42)43)34(53)49-31(22-24-11-14-25-6-1-2-7-26(25)20-24)37(56)50-19-5-10-32(50)36(55)48-30(35(54)47-28)21-23-12-15-27(51)16-13-23/h1-2,6-7,11-16,20,28-32,51H,3-5,8-10,17-19,21-22H2,(H,46,52)(H,47,54)(H,48,55)(H,49,53)(H4,40,41,44)(H4,42,43,45)/t28-,29-,30+,31+,32-/s2
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n/an/a>3.00E+4n/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Inhibition of [125I]SDF-1alpha binding to CXCR7 (unknown origin) expressed in CHO cell membranes incubated for 1 hr by radioligand displacement assay


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


(Homo sapiens)
BDBM50092200
PNG
(CHEMBL3581282)
Show SMILES C[C@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@H](Cc2ccc3ccccc3c2)NC(=O)[C@H](CCCNC(N)=N)N(C)C(=O)[C@H](CCCNC(N)=N)NC1=O
Show InChI InChI=1/C34H49N11O5/c1-20-28(46)42-24(10-5-15-39-33(35)36)31(49)44(2)26(11-6-16-40-34(37)38)29(47)43-25(32(50)45-17-7-12-27(45)30(48)41-20)19-21-13-14-22-8-3-4-9-23(22)18-21/h3-4,8-9,13-14,18,20,24-27H,5-7,10-12,15-17,19H2,1-2H3,(H,41,48)(H,42,46)(H,43,47)(H4,35,36,39)(H4,37,38,40)/t20-,24+,25+,26+,27+/s2
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n/an/a>3.00E+4n/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Inhibition of [125I]SDF-1alpha binding to CXCR7 (unknown origin) expressed in CHO cell membranes incubated for 1 hr by radioligand displacement assay


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


(Homo sapiens)
BDBM50092201
PNG
(CHEMBL3581281)
Show SMILES CN1[C@H](Cc2ccc3ccccc3c2)C(=O)N2CCC[C@H]2C(=O)N[C@H](Cc2ccc(O)cc2)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C1=O
Show InChI InChI=1/C40H53N11O6/c1-50-33(23-25-12-15-26-7-2-3-8-27(26)21-25)38(57)51-20-6-11-32(51)36(55)49-31(22-24-13-16-28(52)17-14-24)35(54)47-29(9-4-18-45-39(41)42)34(53)48-30(37(50)56)10-5-19-46-40(43)44/h2-3,7-8,12-17,21,29-33,52H,4-6,9-11,18-20,22-23H2,1H3,(H,47,54)(H,48,53)(H,49,55)(H4,41,42,45)(H4,43,44,46)/t29-,30-,31+,32-,33+/s2
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n/an/a>3.00E+4n/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Inhibition of [125I]SDF-1alpha binding to CXCR7 (unknown origin) expressed in CHO cell membranes incubated for 1 hr by radioligand displacement assay


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


(Homo sapiens)
BDBM50092259
PNG
(CHEMBL3581285)
Show SMILES C[C@@H]1NC(=O)[C@H](CCCNC(N)=N)N(C)C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2ccc(O)cc2)NC(=O)[C@@H]2CCCN2C1=O
Show InChI InChI=1/C30H47N11O6/c1-17-27(46)41-15-5-8-23(41)26(45)39-21(16-18-9-11-19(42)12-10-18)24(43)38-20(6-3-13-35-29(31)32)28(47)40(2)22(25(44)37-17)7-4-14-36-30(33)34/h9-12,17,20-23,42H,3-8,13-16H2,1-2H3,(H,37,44)(H,38,43)(H,39,45)(H4,31,32,35)(H4,33,34,36)/t17-,20-,21+,22-,23-/s2
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n/an/a>3.00E+4n/an/an/an/an/an/a



Kyoto University

Curated by ChEMBL


Assay Description
Inhibition of [125I]SDF-1alpha binding to CXCR7 (unknown origin) expressed in CHO cell membranes incubated for 1 hr by radioligand displacement assay


Citation and Details
More data for this
Ligand-Target Pair
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