Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | THRA | P10827 | 3/20 | 0.33 |
| ▸ | THRB | P10828 | 3/20 | 0.33 |
| ▸ | KLK1 | P06870 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 3/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.30 |
| ▸ | PLAU | P00749 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4611743 | 0.92 | PTGDR2 (0.36) | PTGDR2CYP2D6CYP3A4HRH3KDM4E | |
| SCHEMBL19182349 | 0.90 | ALDH1A1 (0.36) | CYP2D6HRH3KDM4EALDH1A1THRA | |
| SCHEMBL10808441 | 0.85 | KLK1 (0.38) | CYP2D6HRH3KDM4EALDH1A1THRA | |
| SCHEMBL12370664 | 0.82 | KLK1 (0.44) | HRH3KDM4EALDH1A1THRATHRB | |
| SCHEMBL2149480 | 0.77 | THRA (0.41) | PTGDR2CYP2D6CYP3A4KDM4EALDH1A1 | |
| SCHEMBL1530698 | 0.74 | HSD17B10 (0.47) | PTGDR2CYP3A4ALDH1A1MEN1KMT2A | |
| SCHEMBL15709517 | 0.74 | PTGDR2 (0.39) | PTGDR2KDM4EALDH1A1MEN1KMT2A | |
| SCHEMBL12370674 | 0.74 | ALDH1A1 (0.58) | CYP3A4HRH3KDM4EALDH1A1THRA | |
| SCHEMBL30883280 | 0.73 | KLK1 (0.39) | CYP2D6CYP3A4HRH3KDM4EALDH1A1 | |
| SCHEMBL7140056 | 0.73 | PTGDR2 (0.38) | PTGDR2CYP2D6CYP3A4KDM4EALDH1A1 |
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-0907646-B1 | DIHYDROBENZOPYRAN AND RELATED COMPOUNDS USEFUL AS ANTI-INFLAMMATORY AGENTS | UNIV VANDERBILT (US) | 2003-05-21 | — | — | EP | disclosed |
| US-6110960-A | FOR TREATING ARTHRITIS AND AS ANALGESIC | THE PROCTER & GAMBLE COMPANY (US) | 2000-08-29 | — | — | US | disclosed |