Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FYN | P06241 | 1/20 | 0.50 |
| ▸ | ABL1 | P00519 | 3/20 | 0.49 |
| ▸ | ABCB1 | P08183 | 3/20 | 0.49 |
| ▸ | BCR | P11274 | 3/20 | 0.49 |
| ▸ | VCP | P55072 | 1/20 | 0.47 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.46 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.44 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.44 |
| ▸ | GSK3B | P49841 | 1/20 | 0.44 |
| ▸ | PPARG | P37231 | 1/20 | 0.43 |
| ▸ | PPARD | Q03181 | 1/20 | 0.43 |
| ▸ | PPARA | Q07869 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6539721 | 0.84 | ESR2 (0.55) | ABL1ABCB1BCRGSK3BKDM4E | |
| 2-Mercaptoethanol SCHEMBL11751369 | 0.82 | HSD17B10 (0.47) | NOTUMDYRK1ACLK4GSK3BHSD17B10 | |
| SCHEMBL11751584 | 0.80 | KDM4E (0.47) | NOTUMGSK3BHSD17B10KDM4EMEN1 | |
| SCHEMBL27934283 | 0.77 | CYP1A1 (0.45) | ABL1ABCB1BCRGSK3BKDM4E | |
| SCHEMBL27840064 | 0.76 | MAPK14 (0.51) | CLK4GSK3BKDM4EMEN1KMT2A | |
| SCHEMBL24177866 | 0.76 | ABL1 (0.79) | FYNABL1ABCB1BCRMEN1 | |
| SCHEMBL1513611 | 0.76 | ABL1 (0.79) | FYNABL1ABCB1BCRMEN1 | |
| SCHEMBL11752862 | 0.75 | KDM4E (0.50) | NOTUMGSK3BHSD17B10KDM4EMEN1 | |
| SCHEMBL27820747 | 0.74 | CYP1A1 (0.45) | ABL1ABCB1BCRDYRK1ACLK4 | |
| SCHEMBL15665148 | 0.73 | CYP1A1 (0.42) | HSD17B10KDM4ECYP3A4ALDH1A1CYP1A2 |
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-1583749-A1 | OXAZOLE DERIVATIVES AS INHIBITORS OF CYCLOOXYGENASE | Astellas Pharma Inc. (JP) | 2005-10-12 | — | — | EP | disclosed |
| WO-2004065374-A1 | OXAZOLE DERIVATIVES AS INHIBITORS OF CYCLOOXYGENASE | ASTELLAS PHARMA INC. (JP) | 2004-08-05 | — | — | WO | disclosed |