Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | PGK1 | P00558 | 2/20 | 0.38 |
| ▸ | GABRP | O00591 | 1/20 | 0.33 |
| ▸ | GABRD | O14764 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.33 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.33 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.33 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.33 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.33 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.33 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.33 |
| ▸ | GABRE | P78334 | 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 | |
|---|---|---|---|---|
| SCHEMBL31281492 | 0.89 | ALDH1A1 (0.41) | ALDH1A1KDM4ECYP1A2CYP3A4MAPT | |
| SCHEMBL20500276 | 0.89 | ALDH1A1 (0.41) | ALDH1A1KDM4ECYP1A2CYP3A4MAPT | |
| SCHEMBL6304363 | 0.85 | CYP3A4 (0.42) | ALDH1A1KDM4ECYP1A2CYP3A4MAPT | |
| SCHEMBL24411060 | 0.82 | KDM4E (0.41) | ALDH1A1KDM4ECYP1A2CYP3A4MAPT | |
| SCHEMBL12115806 | 0.82 | ALDH1A1 (0.47) | ALDH1A1KDM4ECYP1A2CYP3A4MAPT | |
| SCHEMBL6789513 | 0.82 | FFAR1 (0.44) | ALDH1A1KDM4ECYP1A2CYP3A4MAPT | |
| SCHEMBL12185498 | 0.82 | KDM4E (0.41) | ALDH1A1KDM4ECYP1A2CYP3A4MAPT | |
| SCHEMBL6304449 | 0.81 | TLR8 (0.40) | PYCR1 | |
| SCHEMBL7203454 | 0.80 | RARB (0.40) | ALDH1A1KDM4ECYP1A2CYP3A4MAPT | |
| SCHEMBL20500278 | 0.79 | CYP1A2 (0.41) | ALDH1A1KDM4ECYP1A2CYP3A4MAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-6784184-B2 | FOR THERAPY OF RAS- ONCOGENE-DEPENDENT TUMORS, SUCH AS CANCERS OF PANCREAS, COLON, BLADDER, AND THYROID; USEFUL FOR CONTROLLING METASTASIS, SUPPRESSING ANGIOGENESIS, INDUCING APOPTOSIS, AND RAS-ASSOCIATED PROLIFERATIVE DISEASES | WYETH HOLDINGS CORPORATION | 2004-08-31 | — | — | US | disclosed |
| US-6605628-B1 | Treatment of ras oncogene-dependent tumors; controlling metastasis, suppressing angiogenesis, inducing apoptosis | WYETH HOLDINGS CORPORATION | 2003-08-12 | — | — | US | disclosed |