Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SERPINE1 | P05121 | 4/20 | 0.50 |
| ▸ | ESR1 | P03372 | 2/20 | 0.50 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.48 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.48 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.48 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | TYR | P14679 | 1/20 | 0.44 |
| ▸ | POLA1 | P09884 | 1/20 | 0.43 |
| ▸ | ANTXR2 | P58335 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL2555282 | 0.88 | ESR1 (0.61) | SERPINE1ESR1AKR1C4AKR1C3AKR1C2 | |
| SCHEMBL2292179 | 0.86 | ESR1 (0.63) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL11234283 | 0.86 | POLB (0.56) | SERPINE1ESR1POLBKDM4EPOLA1 | |
| SCHEMBL28131360 | 0.86 | ALDH1A1 (0.49) | SERPINE1ESR1AKR1C4AKR1C3AKR1C2 | |
| Propyl Gallate SCHEMBL29361471 | 0.85 | SERPINE1 (0.56) | SERPINE1ESR1AKR1C4AKR1C3AKR1C2 | |
| SCHEMBL3696377 | 0.83 | ESR1 (0.67) | SERPINE1ESR1AKR1C4AKR1C3AKR1C2 | |
| SCHEMBL2035001 | 0.77 | POLB (0.51) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL2034409 | 0.77 | POLB (0.51) | ESR1AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL15453542 | 0.77 | LMNA (0.65) | SERPINE1ESR1AKR1C4AKR1C3AKR1C2 | |
| Propyl Gallate SCHEMBL22630 | 0.77 | ESR1 (0.80) | SERPINE1ESR1AKR1C4AKR1C3AKR1C2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011124573-A1 | ORAL CARE COMPOSITIONS | UNILEVER PLC (GB) | 2011-10-13 | — | — | WO | disclosed |