Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 6/20 | 0.66 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.57 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 5/20 | 0.56 |
| ▸ | LMNA | P02545 | 3/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.56 |
| ▸ | HPGD | P15428 | 3/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.52 |
| ▸ | RAB9A | P51151 | 2/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | CNR1 | P21554 | 1/20 | 0.50 |
| ▸ | ACHE | P22303 | 1/20 | 0.50 |
| ▸ | CNR2 | P34972 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL9167621 | 1.00 | CYP19A1 (0.66) | CYP19A1CYSLTR2CYSLTR1MAPTLMNA | |
| SCHEMBL17817183 | 1.00 | CYP19A1 (0.66) | CYP19A1CYSLTR2CYSLTR1MAPTLMNA | |
| SCHEMBL30292299 | 1.00 | CYP19A1 (0.66) | CYP19A1CYSLTR2CYSLTR1MAPTLMNA | |
| SCHEMBL1609478 | 1.00 | CYP19A1 (0.66) | CYP19A1CYSLTR2CYSLTR1MAPTLMNA | |
| SCHEMBL9127581 | 1.00 | CYP19A1 (0.66) | CYP19A1CYSLTR2CYSLTR1MAPTLMNA | |
| SCHEMBL27740868 | 0.96 | MAPT (0.62) | CYP19A1CYSLTR2CYSLTR1MAPTLMNA | |
| SCHEMBL5171515 | 0.94 | MAPT (0.58) | CYP19A1CYSLTR2CYSLTR1MAPTLMNA | |
| SCHEMBL29375687 | 0.91 | MAPT (0.60) | CYP19A1CYSLTR2CYSLTR1MAPTLMNA | |
| SCHEMBL7702894 | 0.91 | MAPT (0.60) | CYP19A1CYSLTR2CYSLTR1MAPTLMNA | |
| SCHEMBL4908553 | 0.89 | CYP19A1 (0.61) | CYP19A1CYSLTR2CYSLTR1MAPTLMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5446189-A | Diester intermediates for diacid enzyme inhibitor | HOFFMANN-LA ROCHE INC. (US) | 1995-08-29 | — | — | US | disclosed |
| US-5324747-A | Treatment of inflammatory diseases | HOFFMANN-LA ROCHE INC. (US) | 1994-06-28 | — | — | US | disclosed |
| EP-0579066-A2 | N-substituted anilines | F. HOFFMANN-LA ROCHE AG (CH) | 1994-01-19 | — | — | EP | disclosed |