Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.41 |
| ▸ | TSHR | P16473 | 4/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | MMP9 | P14780 | 1/20 | 0.35 |
| ▸ | MMP8 | P22894 | 1/20 | 0.35 |
| ▸ | MMP14 | P50281 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4456713 | 0.89 | ALDH1A1 (0.60) | ALDH1A1TDP1CYP3A4TSHRATM | |
| SCHEMBL18860796 | 0.88 | CYP3A4 (0.53) | ALDH1A1TDP1CYP3A4TSHRATM | |
| SCHEMBL4462847 | 0.88 | ALDH1A1 (0.55) | ALDH1A1TDP1CYP3A4TSHRATM | |
| Propylene Glycol SCHEMBL5072616 | 0.87 | ALDH1A1 (0.55) | ALDH1A1TDP1CYP3A4TSHRATM | |
| SCHEMBL8646632 | 0.87 | CYP3A4 (0.51) | ALDH1A1TDP1CYP3A4TSHRATM | |
| SCHEMBL4416992 | 0.85 | ALDH1A1 (0.57) | ALDH1A1TDP1CYP3A4TSHRATM | |
| SCHEMBL9615438 | 0.84 | CYP3A4 (0.50) | ALDH1A1TDP1CYP3A4TSHRATM | |
| SCHEMBL30451836 | 0.82 | ALDH1A1 (0.53) | ALDH1A1TDP1CYP3A4TSHRATM | |
| SCHEMBL30452296 | 0.82 | ALDH1A1 (0.53) | ALDH1A1TDP1CYP3A4TSHRATM | |
| SCHEMBL2113339 | 0.82 | TDP1 (0.50) | TDP1TSHRLMNAHSD17B10USP2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0986624-A1 | CLEANING COMPOSITION AND METHOD OF USE | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 2000-03-22 | — | — | EP | disclosed |
| WO-1998054277-A1 | CLEANING COMPOSITION AND METHOD OF USE | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1998-12-03 | — | — | WO | disclosed |