ASIDSAL CHEM

Asidsal Chem · Scientific Computation

Explore your compounds.
Keep the research connected.

Use Molecule Lab, Docking Lab, Target Discovery and ADMET Lab together or on their own. Save your investigations, add experimental measurements and return to the evidence in your Research Hub.

Browse docking targetsPredict targets for a compoundResearcher plan: batches, exports and one-year docking retention →₦7,500 local / $7.00 international · 31 days
Live

01 / Molecular Analysis

Molecule Lab

Inspect molecular identity, descriptors and drug-likeness alerts. Standardize structures with explicit policies, compare submitted and processed forms, and examine Bemis-Murcko scaffolds.

  • Local browser inspection, no upload required
  • Complete descriptor analysis via scientific service
  • Structure, descriptor and provenance exports
  • Batch analysis with a record for every input
Open Molecule Lab →
75 target protocols

02 / Structure-Based Modelling

Docking Lab

Explore target-specific protocols and inspect recorded poses, protein-ligand interactions and reproducible experiment records with checksums.

  • Recorded reference benchmarks for each target
  • Interactive poses, contacts and experiment comparisons
  • Preparation records and saved protocol settings
  • Downloadable experiment package with provenance
Explore Docking Targets →
Live

03 / Target Discovery

Target Discovery

Predict which protein targets your compound may act on, or see what has already been measured for it and its closest neighbours, with potency, species and citations.

  • Ranked target predictions from the closest known actives
  • 1,344,467 reported measurements across 4,060 targets
  • Potencies as the papers reported them, with units and citations
  • IC50, Ki, Kd and EC50 reported separately, never pooled
  • Species on every target, with a human-only view
  • Citations and licensed provenance on every export
Open Target Discovery →
Live

04 / ADMET Prediction

ADMET Lab

Compare 12 predictions for absorption, distribution, CYP inhibition and toxicity. Review the model behind each result and save linked results to your project.

  • Absorption, solubility, permeability, P-gp and BBB predictions
  • Five CYP inhibition endpoints
  • hERG cardiotoxicity and AMES mutagenicity alerts
  • Side-by-side compound comparisons and exports
Open ADMET Lab →

YOUR RESEARCH WORKSPACE

Bring the results back to your project.

Save notebook snapshots, explore compound evidence and add measurements with their sources. Reopen archived poses and download reports when you need to share your work.

Open Research Hub →

Scientific Standard

Keep the context with the result.

Preserve the input

Keep the submitted representation. Make every structural transformation visible and documented.

Document the method

Record the engine, version, parameters and scope of each calculation alongside the result.

Interpret with context

Review predictions alongside measured evidence, assay conditions and your research question.

Methods & citation →