Phytochemical Compounds from 32 Bone-Mending Plants with Target Predictions

A list of 527 non-redundant phytochemical molecules identified from thirty-two traditional plants used for bone healing. The dataset includes PubChem SMILES strings used for target prediction analyses. It was authored by Mukunda Anuj Sharma and last updated on April 15, 2026.

Use Cases

• Predicting molecular targets for drug discovery based on the provided SMILES strings.
• Screening for bioactive compounds in traditional medicine based on the curated list of 527 molecules.
• Training or validating cheminformatics models using the identified phytochemical constituents.
• Cross-referencing plant-derived compounds with known biological activities for bone health.

Strengths

• Contains 527 non-redundant molecular entries, indicating a deduplicated list.
• Includes PubChem SMILES strings, which are a standard format for chemical structure representation.
• Licensed under CC-BY-4.0, allowing for open sharing and adaptation.

Limitations

• Column-level documentation is absent; field semantics must be inferred after download.
• Row count is unknown, which may limit suitability assessment.
• The description metadata is limited; actual data quality requires manual inspection after download.

Provenance

Source

Mukunda Anuj Sharma via figshare.

Collection Method

Compilation and analysis of phytochemical constituents from literature or databases, as suggested by the description.

Freshness

Last updated 2026-04-15 18:07:45; freshness should be verified.