Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | ATM | Q13315 | 3/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | CDC25B | P30305 | 1/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | CCR6 | P51684 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9266240 | 0.70 | TUBB4A (0.59) | AKR1C3MAPTGAAALDH1A1NPSR1 | |
| SCHEMBL700595 | 0.70 | AKR1C3 (0.85) | AKR1C3MAPTGAAALDH1A1ATM | |
| SCHEMBL29447165 | 0.70 | AKR1C3 (0.85) | AKR1C3MAPTGAAALDH1A1ATM | |
| SCHEMBL857849 | 0.68 | AKR1C3 (0.67) | AKR1C3MAPTGAAALDH1A1ATM | |
| SCHEMBL28883310 | 0.68 | AKR1C3 (0.81) | AKR1C3MAPTGAAALDH1A1ATM | |
| Fluoride SCHEMBL28319246 | 0.68 | AKR1C3 (0.81) | AKR1C3MAPTGAAALDH1A1ATM | |
| SCHEMBL1966793 | 0.67 | FFAR1 (0.41) | — | |
| SCHEMBL28140092 | 0.67 | NAPRT (0.66) | AKR1C3MAPTGAAALDH1A1ATM | |
| SCHEMBL717723 | 0.67 | AKR1C3 (0.64) | AKR1C3MAPTGAAALDH1A1ATM | |
| SCHEMBL9774810 | 0.67 | AKR1C3 (0.64) | AKR1C3MAPTGAAALDH1A1ATM |
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-1414467-A2 | TOPICAL TREATMENT FOR MASTALGIA | Schmidt, Alfred (DE) | 2004-05-06 | — | — | EP | disclosed |
| WO-2002036129-A2 | TOPICAL TREATMENT OF MASTALGIA WITH AROMETESE INHIBITORS SUCH AS ANDROSTENDIONE | SCHMIDT ALFRED (DE) | 2002-05-10 | — | — | WO | disclosed |