Structure-activity relationships for skin sensitization potential: Development of structural alerts for use in knowledge-based toxicity prediction systems

M. P. Payne; P. T. Walsh

doi:10.1021/ci00017a019

Structure-activity relationships for skin sensitization potential: Development of structural alerts for use in knowledge-based toxicity prediction systems

Journal of Chemical Information and Modeling ◽

10.1021/ci00017a019 ◽

1994 ◽

Vol 34 (1) ◽

pp. 154-161 ◽

Cited By ~ 41

Author(s):

M. P. Payne ◽

P. T. Walsh

Keyword(s):

Skin Sensitization ◽

Toxicity Prediction ◽

Structure Activity Relationships ◽

Knowledge Based ◽

Structure Activity ◽

Potential Development ◽

Structural Alerts ◽

Prediction Systems

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Identification and description of the uncertainty, variability, bias and influence in quantitative structure-activity relationships (QSARs) for toxicity prediction

Regulatory Toxicology and Pharmacology ◽

10.1016/j.yrtph.2019.04.007 ◽

2019 ◽

Vol 106 ◽

pp. 90-104 ◽

Cited By ~ 10

Author(s):

Mark T.D. Cronin ◽

Andrea-Nicole Richarz ◽

Terry W. Schultz

Keyword(s):

Quantitative Structure ◽

Toxicity Prediction ◽

Structure Activity Relationships ◽

Structure Activity ◽

Quantitative Structure Activity Relationships

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Rapid toxicity prediction of organic chemicals to Chlorella vulgaris using quantitative structure–activity relationships methods

Ecotoxicology and Environmental Safety ◽

10.1016/j.ecoenv.2008.09.002 ◽

2009 ◽

Vol 72 (3) ◽

pp. 787-794 ◽

Cited By ~ 11

Author(s):

Binbin Xia ◽

Kunping Liu ◽

Zhiguo Gong ◽

Bo Zheng ◽

Xiaoyun Zhang ◽

...

Keyword(s):

Chlorella Vulgaris ◽

Organic Chemicals ◽

Quantitative Structure ◽

Toxicity Prediction ◽

Structure Activity Relationships ◽

Structure Activity ◽

Quantitative Structure Activity Relationships

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Structure activity relationships in skin sensitization using the murine local lymph node assay

Toxicology ◽

10.1016/0300-483x(95)03132-y ◽

1995 ◽

Vol 103 (3) ◽

pp. 177-194 ◽

Cited By ~ 91

Author(s):

J Ashby

Keyword(s):

Lymph Node ◽

Skin Sensitization ◽

Local Lymph Node Assay ◽

Structure Activity Relationships ◽

Structure Activity ◽

Local Lymph Node

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Toxicity prediction of chemicals based on structure-activity relationships

Toxicology Letters ◽

10.1016/s0378-4274(98)80129-x ◽

1998 ◽

Vol 95 ◽

pp. 33-34

Author(s):

M. Nakadate

Keyword(s):

Toxicity Prediction ◽

Structure Activity Relationships ◽

Structure Activity

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Skin-sensitization structure-activity relationships for aldehydes

Contact Dermatitis ◽

10.1034/j.1600-0536.2001.044006331.x ◽

2001 ◽

Vol 44 (6) ◽

pp. 331-336 ◽

Cited By ~ 68

Author(s):

Grace Patlewicz ◽

David A. Basketter ◽

Camilla K. Smith ◽

Sharon A. M. Hotchkiss ◽

David W. Roberts

Keyword(s):

Skin Sensitization ◽

Structure Activity Relationships ◽

Structure Activity

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Toxicity prediction of chemicals based on structure-activity relationships

Toxicology Letters ◽

10.1016/s0378-4274(98)00270-7 ◽

1998 ◽

Vol 102-103 ◽

pp. 627-629 ◽

Cited By ~ 4

Author(s):

Masahiro Nakadate

Keyword(s):

Toxicity Prediction ◽

Structure Activity Relationships ◽

Structure Activity

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Structure-activity relationships in the murine local lymph node assay for skin sensitization: ?,?-diketones

Contact Dermatitis ◽

10.1111/j.1600-0536.1999.tb06201.x ◽

1999 ◽

Vol 41 (1) ◽

pp. 14-17 ◽

Cited By ~ 31

Author(s):

D. W. Roberts ◽

M. York ◽

D. A. Basketter

Keyword(s):

Lymph Node ◽

Skin Sensitization ◽

Local Lymph Node Assay ◽

Structure Activity Relationships ◽

Structure Activity ◽

Local Lymph Node

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Probabilistic hazard assessment for skin sensitization potency by dose-response modeling using feature elimination instead of quantitative structure-activity relationships

Journal of Applied Toxicology ◽

10.1002/jat.3172 ◽

2015 ◽

Vol 35 (11) ◽

pp. 1361-1371 ◽

Cited By ~ 21

Author(s):

Thomas Luechtefeld ◽

Alexandra Maertens ◽

James M. McKim ◽

Thomas Hartung ◽

Andre Kleensang ◽

...

Keyword(s):

Hazard Assessment ◽

Dose Response ◽

Skin Sensitization ◽

Quantitative Structure ◽

Probabilistic Hazard Assessment ◽

Structure Activity Relationships ◽

Structure Activity ◽

Quantitative Structure Activity Relationships ◽

Response Modeling

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Mining toxicity structural alerts from SMILES: A new way to derive Structure Activity Relationships

2011 IEEE Symposium on Computational Intelligence and Data Mining (CIDM) ◽

10.1109/cidm.2011.5949444 ◽

2011 ◽

Cited By ~ 8

Author(s):

Thomas Ferrari ◽

Giuseppina Gini ◽

Nazanin Golbamaki Bakhtyari ◽

Emilio Benfenati

Keyword(s):

Structure Activity Relationships ◽

Structure Activity ◽

Structural Alerts

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Quantitative structure-activity relationships for skin sensitization potential of urushiol analogues

Contact Dermatitis ◽

10.1111/j.1600-0536.1993.tb03487.x ◽

1993 ◽

Vol 29 (2) ◽

pp. 78-83 ◽

Cited By ~ 9

Author(s):

David W. Roberts ◽

Claude Benezra

Keyword(s):

Skin Sensitization ◽

Quantitative Structure ◽

Structure Activity Relationships ◽

Structure Activity ◽

Quantitative Structure Activity Relationships

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