Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 9/20 | 0.52 |
| ▸ | DAO | P14920 | 7/20 | 0.47 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.41 |
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | ALAD | P13716 | 1/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11167795 | 0.83 | GSK3B (0.50) | GSK3BPTPN1CES2CES1 | |
| SCHEMBL71474 | 0.79 | DAO (0.58) | GSK3BDAOCES2CES1ALAD | |
| SCHEMBL939177 | 0.79 | GSK3B (0.46) | GSK3B | |
| SCHEMBL11161465 | 0.79 | GSK3B (0.46) | GSK3BDAOPTPN1CES2CES1 | |
| SCHEMBL15282434 | 0.78 | GSK3B (0.68) | GSK3BDAOPTPN1CES2CES1 | |
| SCHEMBL6198736 | 0.76 | CA12 (0.45) | GSK3B | |
| SCHEMBL25184460 | 0.76 | GSK3B (0.50) | GSK3BPTPN1CES2CES1 | |
| SCHEMBL22953102 | 0.74 | GSK3B (0.48) | GSK3BPTPN1CES2CES1ALAD | |
| SCHEMBL15547606 | 0.74 | DAO (0.59) | GSK3BDAOCES2CES1 | |
| SCHEMBL5350815 | 0.74 | DAO (0.57) | GSK3BDAOCES2CES1ALAD |
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-0816352-B1 | Bi-aryl heterocyclic compounds and their use in human or veterinary medicine and in cosmetics | CT INTERNAT DE (FR) | 2001-02-21 | — | — | EP | disclosed |
| EP-0816352-A1 | Bi-aryl heterocyclic compounds and their use in human or veterinary medicine and in cosmetics | CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (C.I.R.D. GALDERMA) (FR) | 1998-01-07 | — | — | EP | disclosed |