Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.58 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.53 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.49 |
| ▸ | PKLR | P30613 | 1/20 | 0.48 |
| ▸ | MGAT2 | Q10469 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | MMP7 | P09237 | 2/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | HTR7 | P34969 | 1/20 | 0.39 |
| ▸ | MMP2 | P08253 | 1/20 | 0.38 |
| ▸ | MMP9 | P14780 | 1/20 | 0.38 |
| ▸ | MMP8 | P22894 | 1/20 | 0.38 |
| ▸ | MMP13 | P45452 | 1/20 | 0.38 |
| ▸ | MMP14 | P50281 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6951212 | 0.83 | PKLR (0.51) | ALDH1A1CYP1A2CYP2C9CYP2C19PKLR | |
| SCHEMBL6951305 | 0.79 | MGAT2 (0.60) | ALDH1A1CYP1A2POLBL3MBTL1PKLR | |
| SCHEMBL9942053 | 0.75 | ALDH1A1 (0.72) | ALDH1A1CYP1A2CYP2C9CYP2C19POLB | |
| SCHEMBL7812463 | 0.75 | MGAT2 (0.56) | ALDH1A1CYP1A2POLBL3MBTL1PKLR | |
| SCHEMBL4513298 | 0.75 | ALDH1A1 (0.81) | ALDH1A1CYP1A2CYP2C9CYP2C19POLB | |
| SCHEMBL4515726 | 0.75 | ALDH1A1 (0.81) | ALDH1A1CYP1A2CYP2C9CYP2C19POLB | |
| SCHEMBL13889012 | 0.73 | ALDH1A1 (0.83) | ALDH1A1CYP1A2CYP2C9CYP2C19POLB | |
| SCHEMBL4501291 | 0.72 | ALDH1A1 (0.81) | ALDH1A1CYP1A2CYP2C9CYP2C19POLB | |
| SCHEMBL4517771 | 0.70 | ALDH1A1 (0.81) | ALDH1A1CYP1A2CYP2C9CYP2C19POLB | |
| SCHEMBL4512039 | 0.70 | ALDH1A1 (0.76) | ALDH1A1CYP1A2CYP2C9CYP2C19POLB |
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-0988035-B1 | CASPASES AND APOPTOSIS | SMITHKLINE BEECHAM CORP (US) | 2003-05-02 | — | — | EP | claimed |
| US-6214858-B1 | PREVENTING AND TREATING EXCESSIVE CELL DEATH USING OXINDOLE DERIVATIVES | SMITHKLINE BEECHAM CORPORATION | 2001-04-10 | — | — | US | claimed |
| EP-0988035-B1 | CASPASES AND APOPTOSIS | SMITHKLINE BEECHAM CORP (US) | 2003-05-02 | — | — | EP | disclosed |
| US-6214858-B1 | PREVENTING AND TREATING EXCESSIVE CELL DEATH USING OXINDOLE DERIVATIVES | SMITHKLINE BEECHAM CORPORATION | 2001-04-10 | — | — | US | disclosed |