patsnap-chemistry-small-molecule

patsnap-chemistry-small-molecule is a skill for Claude Code, Codex from patsnap/mcp. It costs 45 tokens per session (630 once invoked), scanned A, a copy of patsnap-maintain-payment, Apache-2.0.

A chemistry research connection for small molecules, meaning chemical compounds made of relatively small numbers of atoms. It searches chemical structures, explains structure details, and predicts ADMET properties—how a compound may be absorbed, distributed, metabolised, excreted, and affect the body.

In plain words
What is it for?
Searching for exact or related chemical structures, examining compound characteristics, and predicting ADMET properties.
Why use it?
It helps compare compounds and assess early drug-development questions from a chemical structure rather than relying only on names or manual calculations.

Skill for Claude CodeCodex

Written for no agent in particular: nothing here depends on one.

Good fit Searching for exact or related chemical structures, examining compound characteristics, and predicting ADMET properties.

Compare 6 skills from other repositories ↓
Install with agentmods
npx agentmods add skills/patsnap/mcp/patsnap-chemistry-small-molecule
Install

Getting it into your agent

One page per mod, every tool's command on it. A separate URL per tool would split the same page into five that compete with each other.

Any agent
npx skills add patsnap/mcp --skill patsnap-chemistry-small-molecule
Clone the repo
git clone --depth 1 https://github.com/patsnap/mcp

Made for: Claude Code, Codex.

Wrote this? Show the measurements

A badge with what this costs and how it scanned, read live from this page, so it follows the numbers instead of freezing them. Markdown for a README, HTML for a documentation site or a project page.

agentmods badge for patsnap-chemistry-small-molecule

README.md
[![agentmods](https://agentmods.dev/badge/skills/patsnap/mcp/patsnap-chemistry-small-molecule/github.svg)](https://agentmods.dev/skills/patsnap/mcp/patsnap-chemistry-small-molecule)
Your own site
<a href="https://agentmods.dev/skills/patsnap/mcp/patsnap-chemistry-small-molecule"><img src="https://agentmods.dev/badge/skills/patsnap/mcp/patsnap-chemistry-small-molecule/github.svg" alt="Measured on agentmods" height="20"></a>

Or the 80×15 button, for a site that already has a row of RSS and ATOM ones. Only the verdict fits; the numbers stay here.

agentmods 80×15 button for patsnap-chemistry-small-molecule

Your own site · 80×15
<a href="https://agentmods.dev/skills/patsnap/mcp/patsnap-chemistry-small-molecule"><img src="https://agentmods.dev/badge/skills/patsnap/mcp/patsnap-chemistry-small-molecule.svg" alt="Reviewed on agentmods" width="80" height="20"></a>
Per session 45 Skills are progressive disclosure: only the name and description are preloaded; the body loads when the skill is used.
When invoked 630 The whole file, excluding the scripts and references it only reads on demand.
Security scan A 0 findings. A grade says what 26 rules found in the file — not that it is safe.
Origin 80% copy Near-identical to another mod in the catalogue.
Token cost

What it costs to keep this loaded

Counted locally with the o200k_base tokenizer, which is exact for GPT models; Claude uses its own tokenizer and its counts differ. Treat this as one consistent yardstick across the catalogue rather than a bill. Prices are per million input tokens.

ModelPer sessionOnce invoked
Fable 5.1 $0.00045 $0.00630
Opus 5 $0.00023 $0.00315
Sonnet 5 $0.00009 $0.00126
Haiku 4.5 $0.00005 $0.00063

Measured 12d ago against content hash d9b9f01712fe, method: parsed. Prices are Anthropic first-party input rates as of 2026-09-12, from the pricing page.

Security

Grade A, and why

patsnap-chemistry-small-molecule scanned grade A with 0 findings against 26 rules in 11 categories — prompt injection, anti-refusal, data exfiltration, privilege escalation, supply chain, agent snooping, system-prompt leakage, SSRF and excessive agency — measured 12d ago.

A static scan of the body, not an audit. Every finding is printed with the line that produced it so you can judge whether it matters here. A mod is markdown that instructs an agent; that is exactly why what it instructs is worth reading.

Nothing flagged

None of the 26 patterns this scan looks for appear in this file: no shell pipes, no recursive deletes, no credential paths, no hidden text, no instruction-override or anti-refusal phrasing, no agent-config snooping. That is not a guarantee, it is the absence of the things that are checkable.

Origin

This is a copy

80% identical to patsnap-maintain-payment — 56 lines differ, which has more behind it and is treated as the original. This page carries a canonical link to it rather than competing with it.

life-sciences/patsnap-chemistry-small-molecule/SKILL.md · 72 lines

How it starts

The opening of the file, as written. The whole thing — 72 lines — stays where its author put it; the contents beside it link to each section on GitHub.

Setup

Get your API Key at https://open.patsnap.com

Patsnap Chemistry & Small Molecule

This skill connects your AI agent to Patsnap's Chemistry & Small Molecule MCP server — providing professional-grade life sciences intelligence.

Intelligent chemical small molecule analysis platform, covering chemical structure search, structure details analysis, and ADMET property prediction.

Prerequisites

This skill requires the Patsnap Chemistry & Small Molecule MCP server to be configured in your environment:

{
  "mcpServers": {
    "chemistry_small_molecule": {
      "url": "https://connect.patsnap.com/f71d33/logic-mcp?apikey=YOUR_API_KEY",
      "type": "streamableHttp"
    }
  }
}

Get your API key at open.patsnap.com. For the full list of available tools and input parameters, refer to the official MCP server documentation: https://open.patsnap.com/marketplace/mcp-servers/chemistry-small-molecule


Instructions for AI Agents

Step 1: Chemical Entity Recognition

When a user mentions a chemical name, drug, or SMILES string, resolve it to a standard structure or identifier.

Step 2: Structure Search

Use structure_search for exact matches or similarity analogs. Fetch full details with structure_fetch.

Step 3: Property Prediction

Use admet_predict to evaluate drug-likeness and pharmacokinetic properties.

Step 4: Output Synthesis

Present SMILES/InChI, scaffold descriptions, and tabular comparisons of analogs.


Example Workflows

Lead Optimization

  1. Run structure_search with a lead SMILES.
  2. Fetch analog details with structure_fetch.
  3. Predict ADMET with admet_predict to prioritize candidates.

Resources

Read the full file on GitHub · 72 lines

Files

What ships with it

2 files beside SKILL.md in the same directory: the scripts, references and assets a skill reads on demand. Not counted in the per-session cost; read them before you install if any of them is executable.

Changes

What this file has done since we first saw it

Hashed on every crawl. A supply-chain change to an agent config is a question of when, not whether, so the history is kept rather than the latest state alone.

  1. 12d ago First seen · 72 lines · 45 tokens per session scan A d9b9f01712fe

Subscribe to this mod's changes

patsnap-chemistry-small-molecule is a skill published in the GitHub repository patsnap/mcp (111 stars, last pushed 23d ago), licensed Apache-2.0. It adds 45 tokens to every session and 630 once invoked, about $0.0002 per session on Opus 5. A static security scan graded it A with 0 findings. It is 80% identical to patsnap-maintain-payment, differing in 56 lines, and is treated as a copy.

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