Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | FASN | P49327 | 1/20 | 0.38 |
| ▸ | F7 | P08709 | 2/20 | 0.33 |
| ▸ | F3 | P13726 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | OXER1 | Q8TDS5 | 1/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.33 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7524781 | 1.00 | ALDH1A1 (0.43) | ALDH1A1TSHRFASNF7F3 | |
| SCHEMBL6009638 | 1.00 | ALDH1A1 (0.43) | ALDH1A1TSHRFASNF7F3 | |
| SCHEMBL28731028 | 1.00 | ALDH1A1 (0.43) | ALDH1A1TSHRFASNF7F3 | |
| SCHEMBL6449868 | 1.00 | ALDH1A1 (0.43) | ALDH1A1TSHRFASNF7F3 | |
| SCHEMBL11511291 | 1.00 | ALDH1A1 (0.43) | ALDH1A1TSHRFASNF7F3 | |
| SCHEMBL6009640 | 1.00 | ALDH1A1 (0.43) | ALDH1A1TSHRFASNF7F3 | |
| SCHEMBL11511290 | 1.00 | ALDH1A1 (0.43) | ALDH1A1TSHRFASNF7F3 | |
| SCHEMBL6816149 | 1.00 | ALDH1A1 (0.43) | ALDH1A1TSHRFASNF7F3 | |
| SCHEMBL18300536 | 1.00 | ALDH1A1 (0.43) | ALDH1A1TSHRFASNF7F3 | |
| SCHEMBL25185214 | 0.98 | ALDH1A1 (0.40) | ALDH1A1TSHRFASNF7F3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1592415-A2 | THERAPEUTICALLY ACTIVE COMPOUNDS | Encore Pharmaceuticals, Inc (US) | 2005-11-09 | — | — | EP | disclosed |
| US-20040151758-A1 | Fat substitutes | ENCORE PHARMACEUTICALS, INC. | 2004-08-05 | — | — | US | disclosed |
| WO-2004064761-A2 | THERAPEUTICALLY ACTIVE COMPOUNDS | ENCORE PHARMACEUTICALS, INC. (US) | 2004-08-05 | — | — | WO | disclosed |
| US-20040152777-A1 | Therapeutically active compounds | ENCORE PHARMACEUTICALS, INC. | 2004-08-05 | — | — | US | disclosed |