Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | RARB | P10826 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | MYC | P01106 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7203454 | 0.90 | RARB (0.40) | TSHRALDH1A1CYP1A2KDM4ECYP2C9 | |
| SCHEMBL6785258 | 0.85 | ALDH1A1 (0.49) | TSHRALDH1A1KDM4ECYP2C9MAPT | |
| SCHEMBL3420562 | 0.81 | TSHR (0.42) | TSHRALDH1A1CYP1A2KDM4EMAPT | |
| SCHEMBL6297936 | 0.80 | ALDH1A1 (0.42) | TSHRALDH1A1CYP1A2KDM4ECYP2C9 | |
| SCHEMBL31281492 | 0.77 | ALDH1A1 (0.41) | ALDH1A1CYP1A2KDM4ECYP2C9CYP3A4 | |
| SCHEMBL20500276 | 0.77 | ALDH1A1 (0.41) | ALDH1A1CYP1A2KDM4ECYP2C9CYP3A4 | |
| SCHEMBL6788689 | 0.77 | PTGDR2 (0.44) | ALDH1A1CYP1A2KDM4ECYP2C9CYP3A4 | |
| SCHEMBL6785176 | 0.76 | ALDH1A1 (0.46) | ALDH1A1KDM4EMAPTHPGDGAA | |
| SCHEMBL10454531 | 0.76 | CYP3A4 (0.57) | TSHRALDH1A1CYP1A2KDM4ECYP2C9 | |
| SCHEMBL28049640 | 0.76 | TSHR (0.46) | TSHRALDH1A1CYP1A2KDM4EMAPT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6605628-B1 | Treatment of ras oncogene-dependent tumors; controlling metastasis, suppressing angiogenesis, inducing apoptosis | WYETH HOLDINGS CORPORATION | 2003-08-12 | — | — | US | disclosed |