Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 3/20 | 0.46 |
| ▸ | CES1 | P23141 | 3/20 | 0.46 |
| ▸ | AKR1C3 | P42330 | 4/20 | 0.35 |
| ▸ | AKR1C2 | P52895 | 4/20 | 0.35 |
| ▸ | AGBL2 | Q5U5Z8 | 1/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.34 |
| ▸ | PPARG | P37231 | 2/20 | 0.34 |
| ▸ | EGFR | P00533 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | DRD1 | P21728 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.34 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.34 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.34 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.34 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7088208 | 0.84 | CES2 (0.57) | CES2CES1AKR1C3AKR1C2AGBL2 | |
| SCHEMBL7843292 | 0.83 | CES2 (0.43) | CES2CES1AKR1C3AKR1C2MAPT | |
| SCHEMBL7089429 | 0.80 | PLK1 (0.41) | CES2CES1AKR1C3AKR1C2MAPT | |
| SCHEMBL7508723 | 0.80 | PLK1 (0.41) | CES2CES1AKR1C3AKR1C2MAPT | |
| SCHEMBL7847640 | 0.78 | CES2 (0.49) | CES2CES1AKR1C3AKR1C2ALDH1A1 | |
| SCHEMBL7814039 | 0.75 | CES2 (0.50) | CES2CES1CYP1A2 | |
| SCHEMBL6518724 | 0.74 | CES2 (0.57) | CES2CES1ALDH1A1L3MBTL1 | |
| SCHEMBL7088183 | 0.74 | CES2 (0.62) | CES2CES1 | |
| SCHEMBL14829993 | 0.73 | CES2 (0.61) | CES2CES1ALDH1A1L3MBTL1 | |
| SCHEMBL7843732 | 0.72 | KMT2A (0.39) | CES2CES1AKR1C3AKR1C2MAPT |
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-1125932-A2 | Substituted thiazoles for the treatment of inflammation | G.D. SEARLE & CO. (US) | 2001-08-22 | — | — | EP | disclosed |
| US-5668161-A | Substituted thiazoles for the treatment of inflammation | G.D. SEARLE & CO. (US) | 1997-09-16 | — | — | US | disclosed |