Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 3/20 | 0.76 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.68 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.68 |
| ▸ | CA12 | O43570 | 1/20 | 0.68 |
| ▸ | CA1 | P00915 | 1/20 | 0.68 |
| ▸ | CA2 | P00918 | 1/20 | 0.68 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.68 |
| ▸ | HPGD | P15428 | 1/20 | 0.68 |
| ▸ | CA4 | P22748 | 1/20 | 0.68 |
| ▸ | CA6 | P23280 | 1/20 | 0.68 |
| ▸ | CA7 | P43166 | 1/20 | 0.68 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.68 |
| ▸ | CA9 | Q16790 | 1/20 | 0.68 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.68 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.68 |
| ▸ | LIG1 | P18858 | 1/20 | 0.68 |
| ▸ | CDC25B | P30305 | 2/20 | 0.60 |
| ▸ | ATM | Q13315 | 1/20 | 0.60 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.58 |
| ▸ | GAA | P10253 | 2/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL22129808 | 0.94 | LIG1 (0.76) | AKR1C3ALDH1A1KDM4ECA12CA1 | |
| SCHEMBL29390505 | 0.94 | LIG1 (0.76) | AKR1C3ALDH1A1KDM4ECA12CA1 | |
| Benzene SCHEMBL6034371 | 0.94 | LIG1 (0.76) | AKR1C3ALDH1A1KDM4ECA12CA1 | |
| SCHEMBL36215 | 0.94 | LIG1 (0.76) | AKR1C3ALDH1A1KDM4ECA12CA1 | |
| Ammonia Solution, Strong SCHEMBL28945185 | 0.91 | LIG1 (0.73) | AKR1C3ALDH1A1KDM4ECA12CA1 | |
| Bicarbonate SCHEMBL376894 | 0.91 | LIG1 (0.73) | AKR1C3ALDH1A1KDM4ECA12CA1 | |
| Bicarbonate SCHEMBL3979276 | 0.91 | LIG1 (0.73) | AKR1C3ALDH1A1KDM4ECA12CA1 | |
| SCHEMBL9717050 | 0.91 | LIG1 (0.73) | AKR1C3ALDH1A1KDM4ECA12CA1 | |
| SCHEMBL29254155 | 0.91 | LIG1 (0.73) | AKR1C3ALDH1A1KDM4ECA12CA1 | |
| SCHEMBL11308720 | 0.91 | LIG1 (0.73) | AKR1C3ALDH1A1KDM4ECA12CA1 |
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-4129586-A | Peroxide free radical initiators containing ultraviolet light stabilizing groups | PENNWALT CORPORATION (US) | 1978-12-12 | — | — | US | disclosed |
| US-4055714-A | POLYMERIZATION CATALYSTS | PENNWALT CORPORATION (US) | 1977-10-25 | — | — | US | disclosed |
| US-4045426-A | POLYMERIZATION CATALYSTS | PENNWALT CORPORATION (US) | 1977-08-30 | — | — | US | disclosed |