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ChemBio Discovery Solutions

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Edison, New Jersey, US

About ChemBio Discovery Solutions

ChemBio Discovery Solutions is a professional consultancy and contract research platform founded in 2015 to offer computational modeling services and solutions for small-molecule and biologics (antibody) drug discovery research. Our main mission is to help our clients by providing specialised computational... Show more »

ChemBio Discovery Solutions is a professional consultancy and contract research platform founded in 2015 to offer computational modeling services and solutions for small-molecule and biologics (antibody) drug discovery research. Our main mission is to help our clients by providing specialised computational chemistry and biology services, to rationally and economically tackle the design and discovery obstacles facing drug discovery scientists.

We promise to be highly flexible with our working business models by offering our services (under confidentiality agreements) on a retainer basis (dedicated time for a fixed monthly rate), per project basis (short- and long-term plans), or as per individual needs of clients and project. Our clients include pharmaceutical & biotech companies (small-to-medium size in general), academic research institutes, universities, government laboratories and regulatory institutes.

Recent Publications

  • Khedkar SA, Samad, MA, Choudhary S, Lee JY, Zhau D, Thandhani RI, Karumanchi SA, Rigby AC, Kang PM. Identification of Novel Non-secosteroidal Vitamin D Receptor Modulators with cardioprotective property without calcemic effect. (manuscript in preparation).
  • Khedkar SA, Sun X, Rigby AC, Feinberg MW. Discovery of Small Molecule Inhibitors to Krüppel-Like Factor 10 (KLF10): Implications for Modulation of T Regulatory Cell Differentiation. J Med Chem 2015, 58(3):1466-1478.
  • Gerald D, Adini I, Shechter S, Perruzzi C, Varnau J, Hopkins B, Kazerounian S, Kurschat P, Blachon S, Khedkar SA, Datta M, Sherris D, Prendergast GC, Klagsbrun M, Stuhlmann H, Rigby AC, Nagy JA, Benjamin LE. RhoB controls coordination of adult angiogenesis and lymphangiogenesis following injury by regulating VEZF1-mediated transcription. Nature Commun 2013, 4:2824.
  • Verma J, Malde AK, Khedkar SA, Coutinho EC. Comparative Occupancy Analysis (CoOAn) - A straightforward and directly applicable 3D-QSAR formalism to extract molecular features obligatory for designing potent leads. Mol Inf 2012, 31(6-7):431-442.
  • Thadhani RI, Kisner T, Hagmann H, Bossung V, Noack S, Schaarschmidt W, Jank A, Kribs A, Cornely OA, Kreyssig C, Hemphill L, Rigby AC, Khedkar SA, Lindner TH, Mallmann P, Stepan H, Karumanchi SA, Benzing T. Pilot study of extracorporeal removal of soluble Fms-like Tyrosine Kinase 1 in Preeclampsia. Circulation 2011, 124(8):940-950. Response to letters: Circulation 2012, 125:e523.
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Our Services (22)


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Bioinformatics

Price on request

Sequence alignment, analysis, and manipulation, secondary structure prediction, homology modeling, and analysis of experimental data (e.g. antibody display).

Sequence alignment, analysis, and manipulation, secondary structure prediction, homology modeling, and analysis of experimental data (e.g. antibody display).

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QSAR Studies

Quantitative Structure-Activity Relationship Studies
Price on request

Proprietary peptide QSAR modeling (CoRIA: Comparative Residue Interaction Analysis).

Proprietary peptide QSAR modeling (CoRIA: Comparative Residue Interaction Analysis).

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Automation Consulting

Price on request

Automation of redundant tasks – KNIME workflows, scripts writing, etc.

Automation of redundant tasks – KNIME workflows, scripts writing, etc.

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Drug Repositioning

Price on request

Assistance with drug repurposing, ADME/Tox evaluations.

Assistance with drug repurposing, ADME/Tox evaluations.

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Feasibility Studies

Price on request

Feasibility and exploratory studies on specific targets of interest (TOI).

Feasibility and exploratory studies on specific targets of interest (TOI).

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Combinatorial Chemistry

Price on request

Filtering (PAINS), manipulation (clustering), property analysis & maintenance of molecular libraries

Combinatorial library design– creating focused virtual libraries around leads, or create a library form commercial databases using substructure similarity for binding affinity calculations and ranking.

Filtering (PAINS), manipulation (clustering), property analysis & maintenance of molecular libraries

Combinatorial library design– creating focused virtual libraries around leads, or create a library form commercial databases using substructure similarity for binding affinity calculations and ranking.

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Predictive Modeling

Price on request

Multi-parameter optimization and predictive modeling such as QSAR.

Multi-parameter optimization and predictive modeling such as QSAR.

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Compound Profiling

Price on request

Selectivity profiling of lead compounds against related proteins (to pursue interesting polypharmacology or to avoid off-target activities).

Selectivity profiling of lead compounds against related proteins (to pursue interesting polypharmacology or to avoid off-target activities).

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Hit to Lead and Lead Optimization

Price on request

Structure-based / ligand-based strategies

Structure-based / ligand-based strategies

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Computational Drug Discovery

Price on request

Virtual screening of commercial or corporate libraries

Virtual screening of commercial or corporate libraries

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Computational Modeling

Price on request
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Drug Discovery

Price on request
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Business Development Consulting

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Equipment

Price on request
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Computational Chemistry

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Pharmacology & Toxicology

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Chemistry and Materials

Price on request
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Biostatistics & Bioinformatics

Price on request
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Drug Discovery & Development

Price on request
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Project Management

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Synthetic Chemistry

Price on request
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Lead Identification and Validation

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Santosh Khedkar

Founder

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