Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.56 |
| ▸ | PHLPP2 | Q6ZVD8 | 1/20 | 0.49 |
| ▸ | MPL | P40238 | 5/20 | 0.49 |
| ▸ | THRB | P10828 | 2/20 | 0.49 |
| ▸ | CTRC | Q99895 | 2/20 | 0.48 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | PTPRA | P18433 | 1/20 | 0.44 |
| ▸ | PTPRB | P23467 | 1/20 | 0.44 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL2140576 | 1.00 | ALDH1A1 (0.56) | ALDH1A1CYP1A2PHLPP2MPLTHRB | |
| SCHEMBL92057 | 0.88 | ALDH1A1 (0.72) | ALDH1A1CYP1A2PHLPP2MPLTHRB | |
| SCHEMBL29932227 | 0.88 | ALDH1A1 (0.72) | ALDH1A1CYP1A2PHLPP2MPLTHRB | |
| SCHEMBL1161501 | 0.88 | ALDH1A1 (0.72) | ALDH1A1CYP1A2PHLPP2MPLTHRB | |
| SCHEMBL29362512 | 0.88 | ALDH1A1 (0.72) | ALDH1A1CYP1A2PHLPP2MPLTHRB | |
| SCHEMBL1435737 | 0.87 | ALDH1A1 (0.71) | ALDH1A1CYP1A2PHLPP2MPLTHRB | |
| SCHEMBL3184580 | 0.87 | ALDH1A1 (0.71) | ALDH1A1CYP1A2PHLPP2MPLTHRB | |
| Calcium SCHEMBL30248603 | 0.87 | ALDH1A1 (0.71) | ALDH1A1CYP1A2PHLPP2MPLTHRB | |
| SCHEMBL5786859 | 0.87 | ALDH1A1 (0.71) | ALDH1A1CYP1A2PHLPP2MPLTHRB | |
| SCHEMBL1435734 | 0.87 | ALDH1A1 (0.71) | ALDH1A1CYP1A2PHLPP2MPLTHRB |
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-1880007-A2 | PERSONAL CARE COMPOSITIONS AND METHODS FOR THEIR USE | GENENCOR INTERNATIONAL, INC. (US) | 2008-01-23 | — | — | EP | disclosed |
| WO-2006121610-A2 | PERSONAL CARE COMPOSITIONS AND METHODS FOR THEIR USE | GENENCOR INTERNATIONAL, INC. (US) | 2006-11-16 | — | — | WO | disclosed |