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tooluniverse-chemical-compound-retrieval

Official

Build complete chemical compound profiles.

Data & Analytics#bioactivity#ChEMBL#PubChem#compound#data-retrieval#identifiers#drug-information
Authormims-harvard
Version1.0.0
Installs0

System Documentation

What problem does it solve?

This Skill provides a unified workflow to retrieve and validate chemical compound data from PubChem and ChEMBL, creating reliable profiles with identifiers, properties, bioactivity, and drug information.

Core Features & Use Cases

  • Disambiguation and cross-database validation of compound identity (PubChem CID, ChEMBL ID, SMILES, InChI)
  • Comprehensive compound profiling: identifiers, molecular properties, bioactivity data, and potential drug information
  • Use cases include drug candidate verification, SAR analysis, and research data curation

Quick Start

Use the tooluniverse chemical compound retrieval skill to obtain a complete compound profile for a given query (name, CID, or SMILES). For example, retrieve the PubChem CID and ChEMBL cross-reference for a known drug and fetch its molecular weight and LogP.

Dependency Matrix

Required Modules

None required

Components

Standard package

💻 Claude Code Installation

Recommended: Let Claude install automatically. Simply copy and paste the text below to Claude Code.

Please help me install this Skill:
Name: tooluniverse-chemical-compound-retrieval
Download link: https://github.com/mims-harvard/ToolUniverse/archive/main.zip#tooluniverse-chemical-compound-retrieval

Please download this .zip file, extract it, and install it in the .claude/skills/ directory.
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