Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSA | P10619 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Soman SCHEMBL59654 | 0.93 | CTSA (0.40) | CTSAACHE | |
| Soman SCHEMBL16218373 | 0.93 | CTSA (0.40) | CTSAACHE | |
| Soman SCHEMBL3796733 | 0.93 | CTSA (0.40) | CTSAACHE | |
| Soman SCHEMBL30121116 | 0.91 | CTSA (0.39) | CTSAACHE | |
| Soman SCHEMBL7874079 | 0.87 | CTSA (0.36) | CTSAACHE | |
| Soman SCHEMBL16012017 | 0.87 | CTSA (0.36) | CTSAACHE | |
| Isopropyl Methylphosphonofluoridate SCHEMBL13442719 | 0.83 | — | — | |
| Isopropyl Methylphosphonofluoridate SCHEMBL50256 | 0.83 | — | — | |
| Isopropyl Methylphosphonofluoridate SCHEMBL3917642 | 0.83 | CTSA (0.63) | CTSAACHEKDM4EALDH1A1POLB | |
| Soman SCHEMBL17780216 | 0.83 | CTSA (0.33) | CTSAACHE |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6723890-B2 | ESPECIALLY FOR CHEMICAL WARFARE AND BIOLOGICAL WARFARE AGENTS. | SANDIA CORPORATION | 2004-04-20 | — | — | US | claimed |
| EP-3655529-A1 | NOVEL MUTATED PTE ENZYMES | La Fondation Mediterranee Infection (FR) | 2020-05-27 | — | — | EP | disclosed |
| WO-2019016468-A1 | NOVEL MUTATED PTE ENZYMES | LA FONDATION MEDITERRANEE INFECTION (FR) | 2019-01-24 | — | — | WO | disclosed |
| WO-2011139275-A1 | METHOD OF DETECTING NERVE AGENTS USING NOVEL ASSAY AGENTS | MCLAB (US) | 2011-11-10 | — | — | WO | disclosed |
| CN-101500600-A | Methods for ester detoxication | HUMAN BIOMOLECULAR RES INST (US) | 2009-08-05 | — | — | CN | disclosed |