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Data Sources & Attributions

MolHub is built on open science. We gratefully acknowledge the databases and software below, and use them in accordance with their respective licenses. Where a license requires attribution, that attribution is provided here.

Databases

  • ChEMBL — European Bioinformatics Institute (EMBL-EBI). Data from https://www.ebi.ac.uk/chembl, licensed under CC BY-SA 3.0. Bioactivity data displayed and exported via MolHub originates from ChEMBL and remains subject to its share-alike terms.
  • PubChem — U.S. National Institutes of Health (NIH/NCBI). Data from https://pubchem.ncbi.nlm.nih.gov. NCBI places no restrictions on use; some depositor data may carry third-party rights.
  • AlphaFold Protein Structure Database — Google DeepMind & EMBL-EBI. Predicted structures from https://alphafold.ebi.ac.uk, licensed under CC BY 4.0.
  • RCSB Protein Data Bank (PDB) — experimental structures from https://www.rcsb.org; PDB data is released into the public domain (CC0).
  • ZINC / ZINC-22 — Irwin & Shoichet Laboratories, UCSF. https://zinc.docking.org, licensed under CC BY 4.0. MolHub surfaces individual purchasable compounds on demand and does not redistribute bulk portions of ZINC.
  • Enamine REAL — Enamine Ltd. https://enamine.net. Buyable analogs are surfaced as on-demand lookups with links to the vendor; MolHub does not host or redistribute the Enamine catalog in bulk.

Software

Disclaimer

These resources are provided by their respective owners "as is." Inclusion here does not imply endorsement of MolHub by any data provider. Computational outputs derived from these sources are estimates for research use only and are not medical, clinical, or regulatory advice. If you believe an attribution is missing or incorrect, contact admin@molhub.bio.