Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 5/20 | 0.40 |
| ▸ | HTT | P42858 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
| ▸ | HRH1 | P35367 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1931195 | 0.88 | TSHR (0.57) | CYP2D6CYP2C19TSHRHTTALDH1A1 | |
| SCHEMBL3274387 | 0.86 | CYP2D6 (0.56) | CYP2D6CYP2C19TSHRHTTALDH1A1 | |
| SCHEMBL20268376 | 0.86 | CYP2D6 (0.56) | CYP2D6CYP2C19TSHRHTTALDH1A1 | |
| SCHEMBL19873325 | 0.86 | TSHR (0.55) | CYP2D6CYP2C19TSHRHTTALDH1A1 | |
| SCHEMBL19873329 | 0.86 | TSHR (0.55) | CYP2D6CYP2C19TSHRHTTALDH1A1 | |
| Ammonia Solution, Strong SCHEMBL22444382 | 0.86 | TSHR (0.55) | CYP2D6CYP2C19TSHRHTTALDH1A1 | |
| SCHEMBL19873327 | 0.86 | TSHR (0.55) | CYP2D6CYP2C19TSHRHTTALDH1A1 | |
| SCHEMBL28842403 | 0.85 | CYP2D6 (0.46) | CYP2D6CYP2C19TSHRHTTALDH1A1 | |
| SCHEMBL1964266 | 0.83 | CYP2D6 (0.45) | CYP2D6CYP2C19TSHRHTTALDH1A1 | |
| Carbamic Acid SCHEMBL6285281 | 0.83 | TSHR (0.52) | CYP2D6CYP2C19TSHRHTTALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117940520-A | Composition with antimicrobial properties, in particular biocidal properties, for surface coverings for artificial boards | 瑞士克罗诺泰克股份公司 | 2024-04-26 | — | — | CN | disclosed |
| CN-117597577-A | Method for determining the penetration of adhesive into wood by means of near infrared spectroscopy | 地板技术有限公司 | 2024-02-23 | — | — | CN | disclosed |
| US-4426523-A | Preparation of 1-amino-1,3,5-triazine-2,4(1H, 3H)-diones | BAYER AKTIENGESELLSCHAFT (DE) | 1984-01-17 | — | — | US | disclosed |