Crystallography, quantitative structure-activity relationships, (QSAR) and molecular graphics in a comparative analysis of the inhibition of dihydrofolate reductase from chicken liver and Lactobacillus casei by 4,6-diamino-1,2-dihydro-2,2-dimethyl-1-(substituted-phenyl)-s-triazines

Corwin Hansch; Bruce A. Hathaway; Zongru Guo; Cynthia Dias Selassie; Stephen W. Dietrich; Jeffrey M. Blaney; Robert Langridge; Karl W. Volz; Bernard T. Kaufman

doi:10.1021/jm00368a006

Crystallography, quantitative structure-activity relationships, (QSAR) and molecular graphics in a comparative analysis of the inhibition of dihydrofolate reductase from chicken liver and Lactobacillus casei by 4,6-diamino-1,2-dihydro-2,2-dimethyl-1-(substituted-phenyl)-s-triazines

Journal of Medicinal Chemistry ◽

10.1021/jm00368a006 ◽

1984 ◽

Vol 27 (2) ◽

pp. 129-143 ◽

Cited By ~ 36

Author(s):

Corwin Hansch ◽

Bruce A. Hathaway ◽

Zongru Guo ◽

Cynthia Dias Selassie ◽

Stephen W. Dietrich ◽

...

Keyword(s):

Comparative Analysis ◽

Dihydrofolate Reductase ◽

Lactobacillus Casei ◽

Chicken Liver ◽

Quantitative Structure ◽

Molecular Graphics ◽

Structure Activity Relationships ◽

Structure Activity ◽

Quantitative Structure Activity Relationships

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ChemInform Abstract: CRYSTALLOGRAPHY, QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIPS, (QSAR) AND MOLECULAR GRAPHICS IN A COMPARATIVE ANALYSIS OF THE INHIBITION OF DIHYDROFOLATE REDUCTASE FROM CHICKEN LIVER AND LACTOBACILLUS CASEI BY 4,6-DIAMINO-1,2-DIHYDRO

Chemischer Informationsdienst ◽

10.1002/chin.198429224 ◽

1984 ◽

Vol 15 (29) ◽

Author(s):

C. HANSCH ◽

B. A. HATHAWAY ◽

Z. GUO ◽

C. D. SELASSIE ◽

S. W. DIETRICH ◽

...

Keyword(s):

Comparative Analysis ◽

Dihydrofolate Reductase ◽

Lactobacillus Casei ◽

Chicken Liver ◽

Quantitative Structure ◽

Molecular Graphics ◽

Structure Activity Relationships ◽

Structure Activity ◽

Quantitative Structure Activity Relationships

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On the structure selectivity problem in drug design. A comparative study of benzylpyrimidine inhibition of vertebrate and bacterial dihydrofolate reductase via molecular graphics and quantitative structure-activity relationships

Journal of Medicinal Chemistry ◽

10.1021/jm00128a035 ◽

1989 ◽

Vol 32 (8) ◽

pp. 1895-1905 ◽

Cited By ~ 25

Author(s):

Cynthia Dias Selassie ◽

Zhaoxia Fang ◽

Renli Li ◽

Corwin Hansch ◽

Gargi Debnath ◽

...

Keyword(s):

Drug Design ◽

Comparative Study ◽

Dihydrofolate Reductase ◽

Quantitative Structure ◽

Molecular Graphics ◽

Structure Activity Relationships ◽

Structure Activity ◽

Quantitative Structure Activity Relationships

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Comparison of the inhibition of methotrexate-sensitive and -resistant Lactobacillus casei cell cultures with purified Lactobacillus casei dihydrofolate reductase by 4,6-diamino-1,2-dihydro-2,2-dimethyl-1-(3-substituted-phenyl)-s-triazines. Use of quantitative structure-activity relationships in making inferences about the mechanism of resistance and the structure of the enzyme in situ compared with the enzyme in vitro

Journal of Medicinal Chemistry ◽

10.1021/jm00144a010 ◽

1981 ◽

Vol 24 (12) ◽

pp. 1422-1429 ◽

Cited By ~ 17

Author(s):

Eugene A. Coats ◽

Clara S. Genther ◽

Stephen W. Dietrich ◽

Zong Ru Guo ◽

Corwin Hansch

Keyword(s):

Cell Cultures ◽

Dihydrofolate Reductase ◽

Lactobacillus Casei ◽

Quantitative Structure ◽

Structure Activity Relationships ◽

Mechanism Of Resistance ◽

Structure Activity ◽

Quantitative Structure Activity Relationships

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ChemInform Abstract: COMPARISON OF THE INHIBITION OF ESCHERICHIA COLI AND LACTOBACILLUS CASEI DIHYDROFOLATE REDUCTASE BY 2,4-DIAMINO-5-(SUBSTITUTED-BENZYL)PYRIMIDINES: QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIPS, X-RAY CRYSTALLOGRAPHY, AND COMPUTER GRAP

Chemischer Informationsdienst ◽

10.1002/chin.198249334 ◽

1982 ◽

Vol 13 (49) ◽

Author(s):

C. HANSCH ◽

R. LI ◽

J. M. BLANEY ◽

R. LANGRIDGE

Keyword(s):

Escherichia Coli ◽

Dihydrofolate Reductase ◽

Lactobacillus Casei ◽

Quantitative Structure ◽

X Ray ◽

Structure Activity Relationships ◽

X Ray Crystallography ◽

Structure Activity ◽

Quantitative Structure Activity Relationships

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Quantitative Structure−Activity Relationships of 2,4-Diamino-5-(2-X-benzyl)pyrimidines versus Bacterial and Avian Dihydrofolate Reductase†

Journal of Medicinal Chemistry ◽

10.1021/jm970776j ◽

1998 ◽

Vol 41 (22) ◽

pp. 4261-4272 ◽

Cited By ~ 13

Author(s):

Cynthia Dias Selassie ◽

Wei-Xi Gan ◽

Lara S. Kallander ◽

Teri E. Klein

Keyword(s):

Dihydrofolate Reductase ◽

Quantitative Structure ◽

Structure Activity Relationships ◽

Structure Activity ◽

Quantitative Structure Activity Relationships

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Applications of neural networks in quantitative structure-activity relationships of dihydrofolate reductase inhibitors

Journal of Medicinal Chemistry ◽

10.1021/jm00113a022 ◽

1991 ◽

Vol 34 (9) ◽

pp. 2824-2836 ◽

Cited By ~ 201

Author(s):

T. A. Andrea ◽

Hooshmand Kalayeh

Keyword(s):

Neural Networks ◽

Dihydrofolate Reductase ◽

Quantitative Structure ◽

Structure Activity Relationships ◽

Reductase Inhibitors ◽

Structure Activity ◽

Quantitative Structure Activity Relationships ◽

Dihydrofolate Reductase Inhibitors

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ChemInform Abstract: MULTIVARIATE ANALYSIS AND QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIPS. INHIBITION OF DIHYDROFOLATE REDUCTASE AND THYMIDYLATE SYNTHETASE BY QUINAZOLINES

Chemischer Informationsdienst ◽

10.1002/chin.197940334 ◽

1979 ◽

Vol 10 (40) ◽

Author(s):

B.-K. CHEN ◽

C. HORVATH ◽

J. R. BERTINO

Keyword(s):

Multivariate Analysis ◽

Dihydrofolate Reductase ◽

Thymidylate Synthetase ◽

Quantitative Structure ◽

Structure Activity Relationships ◽

Structure Activity ◽

Quantitative Structure Activity Relationships

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ChemInform Abstract: QUANTITATIVE STRUCTURE-ACTIVITY RELATIONSHIPS BY DISTANCE GEOMETRY: SYSTEMATIC ANALYSIS OF DIHYDROFOLATE REDUCTASE INHIBITORS

Chemischer Informationsdienst ◽

10.1002/chin.198042296 ◽

1980 ◽

Vol 11 (42) ◽

Author(s):

G. M. CRIPPEM

Keyword(s):

Dihydrofolate Reductase ◽

Distance Geometry ◽

Quantitative Structure ◽

Systematic Analysis ◽

Structure Activity Relationships ◽

Reductase Inhibitors ◽

Structure Activity ◽

Quantitative Structure Activity Relationships ◽

Dihydrofolate Reductase Inhibitors

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Quantitative structure–activity relationships (QSAR) for 9-anilinoacridines: a comparative analysis

Chemico-Biological Interactions ◽

10.1016/s0009-2797(98)00085-4 ◽

1998 ◽

Vol 116 (3) ◽

pp. 157-180 ◽

Cited By ~ 11

Author(s):

Hua Gao ◽

William A. Denny ◽

Rajni Garg ◽

Corwin Hansch

Keyword(s):

Comparative Analysis ◽

Quantitative Structure ◽

Structure Activity Relationships ◽

Structure Activity ◽

Quantitative Structure Activity Relationships

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Comparison of quantitative structure-activity relationships of the inhibition of leukemia cells in culture with the inhibition of dihydrofolate reductase from leukemia cells and other cell types

Journal of Medicinal Chemistry ◽

10.1021/jm00344a012 ◽

1982 ◽

Vol 25 (2) ◽

pp. 153-156 ◽

Cited By ~ 9

Author(s):

Tasneem A. Khwaja ◽

Stephanie Pentecost ◽

Cynthia Dias Selassie ◽

Zong Ru Guo ◽

Corwin Hansch

Keyword(s):

Dihydrofolate Reductase ◽

Cell Types ◽

Leukemia Cells ◽

Quantitative Structure ◽

Structure Activity Relationships ◽

Cells In Culture ◽

Structure Activity ◽

Quantitative Structure Activity Relationships

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