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Compile Data Set for Download or QSAR

Found 18 hits of ph data with Target = 'fMet-Leu-Phe receptor 1/2'   
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
fMet-Leu-Phe receptor 1/2


(Homo sapiens (human))
BDBM21692
PNG
(1-(4-chlorophenyl)-3-[1-methyl-3-oxo-2-phenyl-5-(p...)
Show SMILES CC(C)c1c(NC(=O)Nc2ccc(Cl)cc2)c(=O)n(-c2ccccc2)n1C
Show InChI InChI=1S/C20H21ClN4O2/c1-13(2)18-17(23-20(27)22-15-11-9-14(21)10-12-15)19(26)25(24(18)3)16-7-5-4-6-8-16/h4-13H,1-3H3,(H2,22,23,27)
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n/an/an/an/a 44n/an/a7.237



Amgen



Assay Description
hFPRL 1 activity was assayed using an aequorin-based bioluminescence assay (Ca2+ flux). EC50 values have been determined by Ca2+ flux in CHO recombin...


Bioorg Med Chem Lett 17: 6633-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.043
BindingDB Entry DOI: 10.7270/Q25H7DJ4
More data for this
Ligand-Target Pair
fMet-Leu-Phe receptor 1/2


(Homo sapiens (human))
BDBM21709
PNG
(2-ethyl-1-[(3R)-1-[(5-methoxy-1H-1,3-benzodiazol-2...)
Show SMILES CCc1nc2ccccc2n1[C@@H]1CCN(C1)C(=O)c1nc2ccc(OC)cc2[nH]1
Show InChI InChI=1S/C22H23N5O2/c1-3-20-23-17-6-4-5-7-19(17)27(20)14-10-11-26(13-14)22(28)21-24-16-9-8-15(29-2)12-18(16)25-21/h4-9,12,14H,3,10-11,13H2,1-2H3,(H,24,25)/t14-/m1/s1
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n/an/an/an/a 1.87E+3n/an/a7.237



Amgen



Assay Description
hFPRL 1 activity was assayed using an aequorin-based bioluminescence assay (Ca2+ flux). EC50 values have been determined by Ca2+ flux in CHO recombin...


Bioorg Med Chem Lett 17: 6633-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.043
BindingDB Entry DOI: 10.7270/Q25H7DJ4
More data for this
Ligand-Target Pair
fMet-Leu-Phe receptor 1/2


(Homo sapiens (human))
BDBM21694
PNG
(1-{1-[(5-methoxy-1H-indol-2-yl)carbonyl]piperidin-...)
Show SMILES COc1ccc2[nH]c(cc2c1)C(=O)N1CCC(CC1)n1c2ccccc2[nH]c1=O
Show InChI InChI=1S/C22H22N4O3/c1-29-16-6-7-17-14(12-16)13-19(23-17)21(27)25-10-8-15(9-11-25)26-20-5-3-2-4-18(20)24-22(26)28/h2-7,12-13,15,23H,8-11H2,1H3,(H,24,28)
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n/an/an/an/a 6.39E+3n/an/a7.237



Amgen



Assay Description
hFPRL 1 activity was assayed using an aequorin-based bioluminescence assay (Ca2+ flux). EC50 values have been determined by Ca2+ flux in CHO recombin...


Bioorg Med Chem Lett 17: 6633-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.043
BindingDB Entry DOI: 10.7270/Q25H7DJ4
More data for this
Ligand-Target Pair
fMet-Leu-Phe receptor 1/2


(Homo sapiens (human))
BDBM21695
PNG
(1-{1-[(5-methoxy-1H-indol-2-yl)carbonyl]piperidin-...)
Show SMILES COc1ccc2[nH]c(cc2c1)C(=O)N1CCC(CC1)n1cnc2ccccc12
Show InChI InChI=1S/C22H22N4O2/c1-28-17-6-7-18-15(12-17)13-20(24-18)22(27)25-10-8-16(9-11-25)26-14-23-19-4-2-3-5-21(19)26/h2-7,12-14,16,24H,8-11H2,1H3
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n/an/an/an/a 5.10E+3n/an/a7.237



Amgen



Assay Description
hFPRL 1 activity was assayed using an aequorin-based bioluminescence assay (Ca2+ flux). EC50 values have been determined by Ca2+ flux in CHO recombin...


Bioorg Med Chem Lett 17: 6633-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.043
BindingDB Entry DOI: 10.7270/Q25H7DJ4
More data for this
Ligand-Target Pair
fMet-Leu-Phe receptor 1/2


(Homo sapiens (human))
BDBM21696
PNG
(1-{1-[(5-methoxy-1H-indol-2-yl)carbonyl]piperidin-...)
Show SMILES COc1ccc2[nH]c(cc2c1)C(=O)N1CCC(CC1)n1c(C)nc2ccccc12
Show InChI InChI=1S/C23H24N4O2/c1-15-24-20-5-3-4-6-22(20)27(15)17-9-11-26(12-10-17)23(28)21-14-16-13-18(29-2)7-8-19(16)25-21/h3-8,13-14,17,25H,9-12H2,1-2H3
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n/an/an/an/a 1.02E+3n/an/a7.237



Amgen



Assay Description
hFPRL 1 activity was assayed using an aequorin-based bioluminescence assay (Ca2+ flux). EC50 values have been determined by Ca2+ flux in CHO recombin...


Bioorg Med Chem Lett 17: 6633-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.043
BindingDB Entry DOI: 10.7270/Q25H7DJ4
More data for this
Ligand-Target Pair
fMet-Leu-Phe receptor 1/2


(Homo sapiens (human))
BDBM21697
PNG
(2-ethyl-1-{1-[(5-methoxy-1H-indol-2-yl)carbonyl]pi...)
Show SMILES CCc1nc2ccccc2n1C1CCN(CC1)C(=O)c1cc2cc(OC)ccc2[nH]1
Show InChI InChI=1S/C24H26N4O2/c1-3-23-26-20-6-4-5-7-22(20)28(23)17-10-12-27(13-11-17)24(29)21-15-16-14-18(30-2)8-9-19(16)25-21/h4-9,14-15,17,25H,3,10-13H2,1-2H3
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n/an/an/an/a 690n/an/a7.237



Amgen



Assay Description
hFPRL 1 activity was assayed using an aequorin-based bioluminescence assay (Ca2+ flux). EC50 values have been determined by Ca2+ flux in CHO recombin...


Bioorg Med Chem Lett 17: 6633-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.043
BindingDB Entry DOI: 10.7270/Q25H7DJ4
More data for this
Ligand-Target Pair
fMet-Leu-Phe receptor 1/2


(Homo sapiens (human))
BDBM21698
PNG
(1-{1-[(5-methoxy-1H-indol-2-yl)carbonyl]piperidin-...)
Show SMILES COc1ccc2[nH]c(cc2c1)C(=O)N1CCC(CC1)n1c(CC(C)C)nc2ccccc12
Show InChI InChI=1S/C26H30N4O2/c1-17(2)14-25-28-22-6-4-5-7-24(22)30(25)19-10-12-29(13-11-19)26(31)23-16-18-15-20(32-3)8-9-21(18)27-23/h4-9,15-17,19,27H,10-14H2,1-3H3
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n/an/an/an/a 830n/an/a7.237



Amgen



Assay Description
hFPRL 1 activity was assayed using an aequorin-based bioluminescence assay (Ca2+ flux). EC50 values have been determined by Ca2+ flux in CHO recombin...


Bioorg Med Chem Lett 17: 6633-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.043
BindingDB Entry DOI: 10.7270/Q25H7DJ4
More data for this
Ligand-Target Pair
fMet-Leu-Phe receptor 1/2


(Homo sapiens (human))
BDBM21699
PNG
(1-{1-[(5-methoxy-1H-indol-2-yl)carbonyl]piperidin-...)
Show SMILES COc1ccc2[nH]c(cc2c1)C(=O)N1CCC(CC1)n1c(nc2ccccc12)C(F)(F)F
Show InChI InChI=1S/C23H21F3N4O2/c1-32-16-6-7-17-14(12-16)13-19(27-17)21(31)29-10-8-15(9-11-29)30-20-5-3-2-4-18(20)28-22(30)23(24,25)26/h2-7,12-13,15,27H,8-11H2,1H3
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n/an/an/an/a 1.52E+3n/an/a7.237



Amgen



Assay Description
hFPRL 1 activity was assayed using an aequorin-based bioluminescence assay (Ca2+ flux). EC50 values have been determined by Ca2+ flux in CHO recombin...


Bioorg Med Chem Lett 17: 6633-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.043
BindingDB Entry DOI: 10.7270/Q25H7DJ4
More data for this
Ligand-Target Pair
fMet-Leu-Phe receptor 1/2


(Homo sapiens (human))
BDBM21700
PNG
(1-{1-[(5-methoxy-1H-indol-2-yl)carbonyl]piperidin-...)
Show SMILES COc1ccc2[nH]c(cc2c1)C(=O)N1CCC(CC1)n1c(nc2ccccc12)-c1ccccc1
Show InChI InChI=1S/C28H26N4O2/c1-34-22-11-12-23-20(17-22)18-25(29-23)28(33)31-15-13-21(14-16-31)32-26-10-6-5-9-24(26)30-27(32)19-7-3-2-4-8-19/h2-12,17-18,21,29H,13-16H2,1H3
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n/an/an/an/a 2.71E+3n/an/a7.237



Amgen



Assay Description
hFPRL 1 activity was assayed using an aequorin-based bioluminescence assay (Ca2+ flux). EC50 values have been determined by Ca2+ flux in CHO recombin...


Bioorg Med Chem Lett 17: 6633-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.043
BindingDB Entry DOI: 10.7270/Q25H7DJ4
More data for this
Ligand-Target Pair
fMet-Leu-Phe receptor 1/2


(Homo sapiens (human))
BDBM21701
PNG
(2-ethyl-1-{1-[(5-methoxy-1H-indol-2-yl)carbonyl]py...)
Show SMILES CCc1nc2ccccc2n1C1CCN(C1)C(=O)c1cc2cc(OC)ccc2[nH]1
Show InChI InChI=1S/C23H24N4O2/c1-3-22-25-19-6-4-5-7-21(19)27(22)16-10-11-26(14-16)23(28)20-13-15-12-17(29-2)8-9-18(15)24-20/h4-9,12-13,16,24H,3,10-11,14H2,1-2H3
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n/an/an/an/a 130n/an/a7.237



Amgen



Assay Description
hFPRL 1 activity was assayed using an aequorin-based bioluminescence assay (Ca2+ flux). EC50 values have been determined by Ca2+ flux in CHO recombin...


Bioorg Med Chem Lett 17: 6633-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.043
BindingDB Entry DOI: 10.7270/Q25H7DJ4
More data for this
Ligand-Target Pair
fMet-Leu-Phe receptor 1/2


(Homo sapiens (human))
BDBM21702
PNG
(2-ethyl-1-[(3R)-1-[(5-methoxy-1H-indol-2-yl)carbon...)
Show SMILES CCc1nc2ccccc2n1[C@@H]1CCN(C1)C(=O)c1cc2cc(OC)ccc2[nH]1
Show InChI InChI=1S/C23H24N4O2/c1-3-22-25-19-6-4-5-7-21(19)27(22)16-10-11-26(14-16)23(28)20-13-15-12-17(29-2)8-9-18(15)24-20/h4-9,12-13,16,24H,3,10-11,14H2,1-2H3/t16-/m1/s1
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n/an/an/an/a 34n/an/a7.237



Amgen



Assay Description
hFPRL 1 activity was assayed using an aequorin-based bioluminescence assay (Ca2+ flux). EC50 values have been determined by Ca2+ flux in CHO recombin...


Bioorg Med Chem Lett 17: 6633-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.043
BindingDB Entry DOI: 10.7270/Q25H7DJ4
More data for this
Ligand-Target Pair
fMet-Leu-Phe receptor 1/2


(Homo sapiens (human))
BDBM21703
PNG
(2-ethyl-1-[(3S)-1-[(5-methoxy-1H-indol-2-yl)carbon...)
Show SMILES CCc1nc2ccccc2n1[C@H]1CCN(C1)C(=O)c1cc2cc(OC)ccc2[nH]1
Show InChI InChI=1S/C23H24N4O2/c1-3-22-25-19-6-4-5-7-21(19)27(22)16-10-11-26(14-16)23(28)20-13-15-12-17(29-2)8-9-18(15)24-20/h4-9,12-13,16,24H,3,10-11,14H2,1-2H3/t16-/m0/s1
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n/an/an/an/a 3.50E+3n/an/a7.237



Amgen



Assay Description
hFPRL 1 activity was assayed using an aequorin-based bioluminescence assay (Ca2+ flux). EC50 values have been determined by Ca2+ flux in CHO recombin...


Bioorg Med Chem Lett 17: 6633-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.043
BindingDB Entry DOI: 10.7270/Q25H7DJ4
More data for this
Ligand-Target Pair
fMet-Leu-Phe receptor 1/2


(Homo sapiens (human))
BDBM21704
PNG
(2-ethyl-1-[(3R)-1-[(5-fluoro-1H-indol-2-yl)carbony...)
Show SMILES CCc1nc2ccccc2n1[C@@H]1CCN(C1)C(=O)c1cc2cc(F)ccc2[nH]1
Show InChI InChI=1S/C22H21FN4O/c1-2-21-25-18-5-3-4-6-20(18)27(21)16-9-10-26(13-16)22(28)19-12-14-11-15(23)7-8-17(14)24-19/h3-8,11-12,16,24H,2,9-10,13H2,1H3/t16-/m1/s1
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n/an/an/an/a 1.49E+3n/an/a7.237



Amgen



Assay Description
hFPRL 1 activity was assayed using an aequorin-based bioluminescence assay (Ca2+ flux). EC50 values have been determined by Ca2+ flux in CHO recombin...


Bioorg Med Chem Lett 17: 6633-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.043
BindingDB Entry DOI: 10.7270/Q25H7DJ4
More data for this
Ligand-Target Pair
fMet-Leu-Phe receptor 1/2


(Homo sapiens (human))
BDBM21705
PNG
(1-[(3R)-1-[(5-chloro-1H-indol-2-yl)carbonyl]pyrrol...)
Show SMILES CCc1nc2ccccc2n1[C@@H]1CCN(C1)C(=O)c1cc2cc(Cl)ccc2[nH]1
Show InChI InChI=1S/C22H21ClN4O/c1-2-21-25-18-5-3-4-6-20(18)27(21)16-9-10-26(13-16)22(28)19-12-14-11-15(23)7-8-17(14)24-19/h3-8,11-12,16,24H,2,9-10,13H2,1H3/t16-/m1/s1
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n/an/an/an/a 1.41E+4n/an/a7.237



Amgen



Assay Description
hFPRL 1 activity was assayed using an aequorin-based bioluminescence assay (Ca2+ flux). EC50 values have been determined by Ca2+ flux in CHO recombin...


Bioorg Med Chem Lett 17: 6633-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.043
BindingDB Entry DOI: 10.7270/Q25H7DJ4
More data for this
Ligand-Target Pair
fMet-Leu-Phe receptor 1/2


(Homo sapiens (human))
BDBM21706
PNG
(1-[(3R)-1-[(5-bromo-1H-indol-2-yl)carbonyl]pyrroli...)
Show SMILES CCc1nc2ccccc2n1[C@@H]1CCN(C1)C(=O)c1cc2cc(Br)ccc2[nH]1
Show InChI InChI=1S/C22H21BrN4O/c1-2-21-25-18-5-3-4-6-20(18)27(21)16-9-10-26(13-16)22(28)19-12-14-11-15(23)7-8-17(14)24-19/h3-8,11-12,16,24H,2,9-10,13H2,1H3/t16-/m1/s1
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n/an/an/an/a 810n/an/a7.237



Amgen



Assay Description
hFPRL 1 activity was assayed using an aequorin-based bioluminescence assay (Ca2+ flux). EC50 values have been determined by Ca2+ flux in CHO recombin...


Bioorg Med Chem Lett 17: 6633-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.043
BindingDB Entry DOI: 10.7270/Q25H7DJ4
More data for this
Ligand-Target Pair
fMet-Leu-Phe receptor 1/2


(Homo sapiens (human))
BDBM21707
PNG
(2-ethyl-1-[(3R)-1-{[5-(trifluoromethoxy)-1H-indol-...)
Show SMILES CCc1nc2ccccc2n1[C@@H]1CCN(C1)C(=O)c1cc2cc(OC(F)(F)F)ccc2[nH]1
Show InChI InChI=1S/C23H21F3N4O2/c1-2-21-28-18-5-3-4-6-20(18)30(21)15-9-10-29(13-15)22(31)19-12-14-11-16(32-23(24,25)26)7-8-17(14)27-19/h3-8,11-12,15,27H,2,9-10,13H2,1H3/t15-/m1/s1
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n/an/an/an/a 1.22E+4n/an/a7.237



Amgen



Assay Description
hFPRL 1 activity was assayed using an aequorin-based bioluminescence assay (Ca2+ flux). EC50 values have been determined by Ca2+ flux in CHO recombin...


Bioorg Med Chem Lett 17: 6633-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.043
BindingDB Entry DOI: 10.7270/Q25H7DJ4
More data for this
Ligand-Target Pair
fMet-Leu-Phe receptor 1/2


(Homo sapiens (human))
BDBM21708
PNG
(2-ethyl-1-[(3R)-1-[(5-ethyl-1H-indol-2-yl)carbonyl...)
Show SMILES CCc1nc2ccccc2n1[C@@H]1CCN(C1)C(=O)c1cc2cc(CC)ccc2[nH]1
Show InChI InChI=1S/C24H26N4O/c1-3-16-9-10-19-17(13-16)14-21(25-19)24(29)27-12-11-18(15-27)28-22-8-6-5-7-20(22)26-23(28)4-2/h5-10,13-14,18,25H,3-4,11-12,15H2,1-2H3/t18-/m1/s1
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n/an/an/an/a 270n/an/a7.237



Amgen



Assay Description
hFPRL 1 activity was assayed using an aequorin-based bioluminescence assay (Ca2+ flux). EC50 values have been determined by Ca2+ flux in CHO recombin...


Bioorg Med Chem Lett 17: 6633-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.043
BindingDB Entry DOI: 10.7270/Q25H7DJ4
More data for this
Ligand-Target Pair
fMet-Leu-Phe receptor 1/2


(Homo sapiens (human))
BDBM21693
PNG
(1-(2-chlorophenyl)-3-[1-methyl-3-oxo-2-phenyl-5-(p...)
Show SMILES CC(C)c1c(NC(=O)Nc2ccccc2Cl)c(=O)n(-c2ccccc2)n1C
Show InChI InChI=1S/C20H21ClN4O2/c1-13(2)18-17(23-20(27)22-16-12-8-7-11-15(16)21)19(26)25(24(18)3)14-9-5-4-6-10-14/h4-13H,1-3H3,(H2,22,23,27)
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n/an/an/an/a>1.00E+4n/an/a7.237



Amgen



Assay Description
hFPRL 1 activity was assayed using an aequorin-based bioluminescence assay (Ca2+ flux). EC50 values have been determined by Ca2+ flux in CHO recombin...


Bioorg Med Chem Lett 17: 6633-7 (2007)


Article DOI: 10.1016/j.bmcl.2007.09.043
BindingDB Entry DOI: 10.7270/Q25H7DJ4
More data for this
Ligand-Target Pair