-
5
-
-
34547923331
-
-
Goulding N.J., and Flowers R.J. (Eds), Birkhauser, Boston
-
In: Goulding N.J., and Flowers R.J. (Eds). Glucocortocoids (2001), Birkhauser, Boston 35-54
-
(2001)
Glucocortocoids
, pp. 35-54
-
-
-
7
-
-
18144444807
-
-
Reichardt H.M., Kaestner K.H., Tuckermann J., Kretz O., Wessely O., Bock R., Gass P., Schmid W., Herrlich P., Angel P., and Schutz G. Cell 93 (1998) 531
-
(1998)
Cell
, vol.93
, pp. 531
-
-
Reichardt, H.M.1
Kaestner, K.H.2
Tuckermann, J.3
Kretz, O.4
Wessely, O.5
Bock, R.6
Gass, P.7
Schmid, W.8
Herrlich, P.9
Angel, P.10
Schutz, G.11
-
12
-
-
0035253604
-
-
Belvisi M.G., Wicks S., Battram C.H., Bottoms S.E.W., Redford J.E., Woodman P., Brown T.J., Webber S.E., and Foster M.L. J. Immunol. 166 (2001) 1975
-
(2001)
J. Immunol.
, vol.166
, pp. 1975
-
-
Belvisi, M.G.1
Wicks, S.2
Battram, C.H.3
Bottoms, S.E.W.4
Redford, J.E.5
Woodman, P.6
Brown, T.J.7
Webber, S.E.8
Foster, M.L.9
-
14
-
-
22244432464
-
-
Barker M., Clackers M., Demaine D.A., Humphreys D., Johnston M.J., Jones H.T., Pacquet F., Pritchard J.M., Salter M., Shanahan S.E., Skone P.A., Vinader V.M., Uings I., Upton R., McLay I.M., and Macdonald S.J.F. J. Med. Chem. 48 (2005) 4507
-
(2005)
J. Med. Chem.
, vol.48
, pp. 4507
-
-
Barker, M.1
Clackers, M.2
Demaine, D.A.3
Humphreys, D.4
Johnston, M.J.5
Jones, H.T.6
Pacquet, F.7
Pritchard, J.M.8
Salter, M.9
Shanahan, S.E.10
Skone, P.A.11
Vinader, V.M.12
Uings, I.13
Upton, R.14
McLay, I.M.15
Macdonald, S.J.F.16
-
15
-
-
33745834001
-
-
Barker M., Clackers M., Copley R., Demaine D.A., Humphreys D., Inglis G.G.A., Johnston M.J., Jones H.T., Haase M.V., House D., Loiseau R., Nisbet L., Pacquet F., Skone P.A., Shanahan S.E., Tape D., Vinader V.M., Washington M., Uings I., Upton R., McLay I.M., and Macdonald S.J.F. J. Med. Chem. 49 (2006) 4216
-
(2006)
J. Med. Chem.
, vol.49
, pp. 4216
-
-
Barker, M.1
Clackers, M.2
Copley, R.3
Demaine, D.A.4
Humphreys, D.5
Inglis, G.G.A.6
Johnston, M.J.7
Jones, H.T.8
Haase, M.V.9
House, D.10
Loiseau, R.11
Nisbet, L.12
Pacquet, F.13
Skone, P.A.14
Shanahan, S.E.15
Tape, D.16
Vinader, V.M.17
Washington, M.18
Uings, I.19
Upton, R.20
McLay, I.M.21
Macdonald, S.J.F.22
more..
-
16
-
-
27644492383
-
-
De Bosscher K., Berghe W.V., Beck I.M.E., Molle W.V., Hennuyer N., Hapgood C.L., Staels B., Louw A., and Haegeman G. Proc. Natl. Acad. Sci. U.S.A. 102 (2005) 15827
-
(2005)
Proc. Natl. Acad. Sci. U.S.A.
, vol.102
, pp. 15827
-
-
De Bosscher, K.1
Berghe, W.V.2
Beck, I.M.E.3
Molle, W.V.4
Hennuyer, N.5
Hapgood, C.L.6
Staels, B.7
Louw, A.8
Haegeman, G.9
-
18
-
-
2342541071
-
-
Ali A., Thompson C.F., Balkovec J.M., Graham D.W., Hammond M.L., Quraishi N., Tata J.R., Einstein M., Ge L., Harris G., Kelly T.M., Mazur P., Pandit S., Santoro J., Sitlani A., Wang C., Williamson J., Miller D.K., Thompson C.M., Zaller D.M., Forrest M.J., Carballo-Jane E., and Luell S. J. Med. Chem. 47 (2004) 2441
-
(2004)
J. Med. Chem.
, vol.47
, pp. 2441
-
-
Ali, A.1
Thompson, C.F.2
Balkovec, J.M.3
Graham, D.W.4
Hammond, M.L.5
Quraishi, N.6
Tata, J.R.7
Einstein, M.8
Ge, L.9
Harris, G.10
Kelly, T.M.11
Mazur, P.12
Pandit, S.13
Santoro, J.14
Sitlani, A.15
Wang, C.16
Williamson, J.17
Miller, D.K.18
Thompson, C.M.19
Zaller, D.M.20
Forrest, M.J.21
Carballo-Jane, E.22
Luell, S.23
more..
-
19
-
-
0035974689
-
-
Coghlan M.J., Kym P.R., Elmore S.W., Wang A.X., Luly J.R., Wilcox D., Stashko M., Lin C.W., Miner J., Tyree C., Nakane M., Jacobson P., and Lane B.C. J. Med. Chem. 44 (2001) 2879
-
(2001)
J. Med. Chem.
, vol.44
, pp. 2879
-
-
Coghlan, M.J.1
Kym, P.R.2
Elmore, S.W.3
Wang, A.X.4
Luly, J.R.5
Wilcox, D.6
Stashko, M.7
Lin, C.W.8
Miner, J.9
Tyree, C.10
Nakane, M.11
Jacobson, P.12
Lane, B.C.13
-
21
-
-
12144286283
-
-
Elmore S.W., Pratt J.K., Coghlan M.J., Mao Y., Green B.E., Anderson D.D., Stashko M.A., Lin C.W., Falls D., Nakane M., Miller L., Tyree C.M., Miner J.N., and Lane B. Bioorg. Med. Chem. Lett. 14 (2004) 1721
-
(2004)
Bioorg. Med. Chem. Lett.
, vol.14
, pp. 1721
-
-
Elmore, S.W.1
Pratt, J.K.2
Coghlan, M.J.3
Mao, Y.4
Green, B.E.5
Anderson, D.D.6
Stashko, M.A.7
Lin, C.W.8
Falls, D.9
Nakane, M.10
Miller, L.11
Tyree, C.M.12
Miner, J.N.13
Lane, B.14
-
22
-
-
0036070771
-
-
Lin C.W., Makane M., Stashko M., Falls D., Kuk J., Miller L., Huang R., Tyree C., Miner J.N., Rosen J., Kym P.R., Coghlan M.J., Carter G., and Lane B.C. Mol. Pharmacol. 62 (2002) 297
-
(2002)
Mol. Pharmacol.
, vol.62
, pp. 297
-
-
Lin, C.W.1
Makane, M.2
Stashko, M.3
Falls, D.4
Kuk, J.5
Miller, L.6
Huang, R.7
Tyree, C.8
Miner, J.N.9
Rosen, J.10
Kym, P.R.11
Coghlan, M.J.12
Carter, G.13
Lane, B.C.14
-
23
-
-
33845926600
-
-
Regan J., Lee T.W., Zindell R.M., Bekkali Y., Bentzien J., Gilmore T., Hammach A., Kirrane T.M., Kukulka A.J., Kuzmich D., Nelson R.M., Proudfoot J.R., Ralph M., Pelletier J., Souza D., Zuvela-Jelaska L., Nabozny G., and Thomson D.S. J. Med. Chem. 49 (2006) 7887
-
(2006)
J. Med. Chem.
, vol.49
, pp. 7887
-
-
Regan, J.1
Lee, T.W.2
Zindell, R.M.3
Bekkali, Y.4
Bentzien, J.5
Gilmore, T.6
Hammach, A.7
Kirrane, T.M.8
Kukulka, A.J.9
Kuzmich, D.10
Nelson, R.M.11
Proudfoot, J.R.12
Ralph, M.13
Pelletier, J.14
Souza, D.15
Zuvela-Jelaska, L.16
Nabozny, G.17
Thomson, D.S.18
-
24
-
-
34547903380
-
-
Lehmann, M.; Krolikiewicz, K.; Skuballa, W.; Strehlke, P.; Kalkbrenner, F.; Ekerdt, R.; Giesen, C. WO 0032584, 2000.
-
-
-
-
25
-
-
0347719371
-
-
Schacke H., Schottelius A., Docke W.D., Strehlke P., Jaroch S., Schmees N., Rehwinkel H., Hennekes H., and Asadullah K. Proc. Natl. Acad. Sci. U.S.A. 101 (2004) 227
-
(2004)
Proc. Natl. Acad. Sci. U.S.A.
, vol.101
, pp. 227
-
-
Schacke, H.1
Schottelius, A.2
Docke, W.D.3
Strehlke, P.4
Jaroch, S.5
Schmees, N.6
Rehwinkel, H.7
Hennekes, H.8
Asadullah, K.9
-
26
-
-
25144466090
-
-
Betageri R., Zhang Y., Zindell R.M., Kuzmich D., Kirrane T.M., Bentzien J., Cardozo M., Capolino A.J., Fadra T.N., Nelson R.M., Paw Z., Shih D.-T., Shih C.-K., Zuvela-Jelaska L., Nabozny G., and Thomson D. Bioorg. Med. Chem. Lett. 15 (2005) 4761
-
(2005)
Bioorg. Med. Chem. Lett.
, vol.15
, pp. 4761
-
-
Betageri, R.1
Zhang, Y.2
Zindell, R.M.3
Kuzmich, D.4
Kirrane, T.M.5
Bentzien, J.6
Cardozo, M.7
Capolino, A.J.8
Fadra, T.N.9
Nelson, R.M.10
Paw, Z.11
Shih, D.-T.12
Shih, C.-K.13
Zuvela-Jelaska, L.14
Nabozny, G.15
Thomson, D.16
-
27
-
-
34547878845
-
-
This work was previously disclosed in part: Kuzmich, D.; Kirrane, T.; Bekkali, Y.; Zindell, R.; Beck, L.; Nabozny, J.; Proudfoot, J.; Nelson, R.; Shih, S.-K.; Capolino, A.; Paw, Z.; Reilly, P.; Deleon, R.; Thomson, D. In Inflammation Research Association, 12th International Conference, October 3-7, Bolton Landing, NY, USA., Poster A039, 2004.
-
-
-
-
28
-
-
34547899304
-
-
Bekkali, Y.; Cardozo, M. G.; Kirrane, T. M.; Kuzmich, D.; Proudfoot, J. R.; Takahashi, H.; Thomson, D.; Wang, J.; Zindell, R.; Harcken, C. H. J. J.; Razavi, H. PCT Int. Appl. WO 03/082787, 2003.
-
-
-
-
29
-
-
34547916593
-
-
note
-
50 standard deviations of 20-40% about the mean. The ER fluorescence polarization competitive binding assays were performed according to the protocol provided with the Panvera kit P-2614.
-
-
-
-
30
-
-
34547901187
-
-
note
-
50 values. Top concentration in the assay was 2 μM.
-
-
-
-
31
-
-
34547882026
-
-
note
-
50 standard deviations of 30-50% about the mean.
-
-
-
-
33
-
-
0032575057
-
-
RCSB protein data bank id: 1A28
-
Williams S.P., and Sigler P.B. Nature 393 (1998) 392 RCSB protein data bank id: 1A28
-
(1998)
Nature
, vol.393
, pp. 392
-
-
Williams, S.P.1
Sigler, P.B.2
-
34
-
-
18444405534
-
-
Bledsoe R.K., Montana V.G., Stanley T.B., Delves D.J., Apolito C.J., McKee D.D., Consler T.G., Parks D.J., Stewart E.L., Willson T.M., Lambert M.H., Moore J.T., Pearce K.H., and Xu E.H. Cell 110 (2002) 93
-
(2002)
Cell
, vol.110
, pp. 93
-
-
Bledsoe, R.K.1
Montana, V.G.2
Stanley, T.B.3
Delves, D.J.4
Apolito, C.J.5
McKee, D.D.6
Consler, T.G.7
Parks, D.J.8
Stewart, E.L.9
Willson, T.M.10
Lambert, M.H.11
Moore, J.T.12
Pearce, K.H.13
Xu, E.H.14
-
35
-
-
34547882907
-
-
Bledsoe, R. K; Lambert, M. H.; Montana, V. G.; Stewart, E. L.; Xu, E. H. Eur. Pat. Appl. 1375517, 2004;
-
-
-
-
36
-
-
0038265311
-
-
Figure 2a was generated from the GR-LBD/dexamethasone co-crystal structure deposited in the RCSB protein data bank (PBD ID 1P93)
-
Kauppi B., Jakob C., Farnegardh M., Yang J., Ahola H., Alarcon M., Calles K., Engstrom O., Harlan J., Muchmore S., Ramqvist A.-K., Thorell S., Ohman L., Greer J., Gustafsson J.-A., Carlstedt-Duke J., and Carlquist M. J. Biol. Chem. 278 (2003) 22748 Figure 2a was generated from the GR-LBD/dexamethasone co-crystal structure deposited in the RCSB protein data bank (PBD ID 1P93)
-
(2003)
J. Biol. Chem.
, vol.278
, pp. 22748
-
-
Kauppi, B.1
Jakob, C.2
Farnegardh, M.3
Yang, J.4
Ahola, H.5
Alarcon, M.6
Calles, K.7
Engstrom, O.8
Harlan, J.9
Muchmore, S.10
Ramqvist, A.-K.11
Thorell, S.12
Ohman, L.13
Greer, J.14
Gustafsson, J.-A.15
Carlstedt-Duke, J.16
Carlquist, M.17
-
37
-
-
29544437502
-
-
Recently we reported the absolute stereochemistry of the more potent enantiomer in our series, see:
-
Recently we reported the absolute stereochemistry of the more potent enantiomer in our series, see:. Lee T.W., Proudfoot J.R., and Thomson D. Bioorg. Med. Chem. Lett. 16 (2006) 654
-
(2006)
Bioorg. Med. Chem. Lett.
, vol.16
, pp. 654
-
-
Lee, T.W.1
Proudfoot, J.R.2
Thomson, D.3
-
38
-
-
34547856380
-
-
note
-
(S)-Enantiomer of compound 3 was docked into the GR-LDB pocket using the GR-LBD/dexamethasone co-crystal structure deposited in the RCSB protein data bank (PBD ID 1P93) to afford Figure 2b. The docking studies were done using Cerius2, LigandFit. The docking site was defined using dexamethasone and enlarged to fill available space. The energy grid was calculated with a distance-dependent dielectric constant of 1.0 and a non-bonded cutoff distance of 10.0 Å and the grid was extended 5.0 Å from the site. Docking was performed with a flexible ligand. Clustering of the docked ligands was performed using complete linkage with a distance threshold of 1.5 Å. Site partitioning was used with one partition.
-
-
-
-
40
-
-
23444440846
-
-
Fensome A., Bender R., Chopra R., Cohen J., Collins M.A., Hudak V., Malakian K., Lockhead S., Olland A., Svenson K., Terefenko E.A., Unwalla R.J., Wilhelm J.M., Wolfrom S., Zhu Y., Zhang Z., Zhang P., Winneker R.C., and Wrobel J. J. Med. Chem. 48 (2005) 5092
-
(2005)
J. Med. Chem.
, vol.48
, pp. 5092
-
-
Fensome, A.1
Bender, R.2
Chopra, R.3
Cohen, J.4
Collins, M.A.5
Hudak, V.6
Malakian, K.7
Lockhead, S.8
Olland, A.9
Svenson, K.10
Terefenko, E.A.11
Unwalla, R.J.12
Wilhelm, J.M.13
Wolfrom, S.14
Zhu, Y.15
Zhang, Z.16
Zhang, P.17
Winneker, R.C.18
Wrobel, J.19
|