Known targets — ChEMBL curated mechanism
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
The experimentally established mechanism targets of Tuaminoheptane. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 known ✓ | P35372 | 1/20 | 0.73 |
| ▸ | TP53 | P04637 | 1/20 | 0.69 |
| ▸ | LAP3 | P28838 | 2/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.59 |
| ▸ | FDPS | P14324 | 4/20 | 0.56 |
| ▸ | S1PR2 | O95136 | 5/20 | 0.55 |
| ▸ | S1PR1 | P21453 | 5/20 | 0.55 |
| ▸ | S1PR3 | Q99500 | 5/20 | 0.55 |
| ▸ | S1PR4 | O95977 | 4/20 | 0.55 |
| ▸ | SMPD1 | P17405 | 3/20 | 0.48 |
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 | |
|---|---|---|---|---|
| Phosphoric Acid SCHEMBL28584800 | 0.98 | OPRM1 (0.70) | OPRM1TP53LAP3ALDH1A1TDP1 | |
| Phosphoric Acid SCHEMBL31513097 | 0.98 | OPRM1 (0.70) | OPRM1TP53LAP3ALDH1A1TDP1 | |
| Phosphoric Acid SCHEMBL28578115 | 0.91 | ALDH1A1 (0.59) | OPRM1TP53LAP3ALDH1A1TDP1 | |
| Tuaminoheptane SCHEMBL37510 | 0.85 | — | — | |
| Tuaminoheptane SCHEMBL353519 | 0.85 | — | — | |
| Tuaminoheptane SCHEMBL354313 | 0.85 | — | — | |
| Tuaminoheptane SCHEMBL25287775 | 0.84 | OPRM1 (0.76) | OPRM1TP53LAP3 | |
| Tuaminoheptane SCHEMBL3365884 | 0.84 | OPRM1 (0.76) | OPRM1TP53LAP3 | |
| Tuaminoheptane SCHEMBL8359697 | 0.84 | OPRM1 (0.76) | OPRM1TP53LAP3 | |
| Phosphoric Acid SCHEMBL27898434 | 0.84 | LAP3 (0.65) | TP53LAP3FDPSS1PR2S1PR1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113252759-A | Electrochemical gas sensor and electrolyte for electrochemical gas sensor | 德尔格安全股份两合公司 | 2021-08-13 | — | — | CN | disclosed |