Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 4/20 | 0.42 |
| ▸ | CACNA2D1 | P54289 | 2/20 | 0.33 |
| ▸ | CACNB3 | P54284 | 1/20 | 0.33 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.33 |
| ▸ | PGR | P06401 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | CACNA2D2 | Q9NY47 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8092519 | 0.91 | TDP1 (0.56) | TDP1TSHRALDH1A1 | |
| SCHEMBL2394452 | 0.88 | — | — | |
| SCHEMBL12319618 | 0.88 | — | — | |
| SCHEMBL15158732 | 0.88 | TSHR (0.53) | TDP1TSHRCACNA2D1CACNB3CACNA1C | |
| SCHEMBL3199611 | 0.85 | — | — | |
| Isobutanol SCHEMBL144682 | 0.79 | TSHR (0.60) | TDP1TSHRALDH1A1MAPK1 | |
| SCHEMBL8052207 | 0.79 | TSHR (0.43) | TDP1TSHRALDH1A1 | |
| SCHEMBL25723386 | 0.78 | TSHR (0.47) | TDP1TSHRCACNA2D1CACNB3CACNA1C | |
| SCHEMBL27414879 | 0.78 | — | — | |
| SCHEMBL17464908 | 0.77 | TSHR (0.36) | TDP1TSHRCACNA2D1CACNB3CACNA1C |
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 |
|---|---|---|---|---|---|---|---|
| US-20030153483-A1 | Concentrated, stable fabric softening composition | TRINH TOAN (US) | 2003-08-14 | — | — | US | claimed |