Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | HMGB1 | P09429 | 1/20 | 0.42 |
| ▸ | CA4 | P22748 | 1/20 | 0.42 |
| ▸ | CA6 | P23280 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2148322 | 0.79 | ALDH1A1 (0.46) | ALDH1A1ALOX15LMNAKDM4EHPGD | |
| SCHEMBL4679095 | 0.76 | ALDH1A1 (0.52) | ALDH1A1ALOX15LMNAKDM4EHPGD | |
| SCHEMBL29022247 | 0.76 | ALDH1A1 (0.52) | ALDH1A1ALOX15LMNAKDM4EHPGD | |
| SCHEMBL14058694 | 0.75 | PARP1 (0.36) | ALDH1A1LMNAKDM4EHPGDSMN1; SMN2 | |
| Phthalic Acid SCHEMBL9015682 | 0.74 | ALDH1A1 (0.70) | ALDH1A1ALOX15LMNAKDM4EHPGD | |
| Phthalic Acid SCHEMBL9015687 | 0.74 | ALDH1A1 (0.70) | ALDH1A1ALOX15LMNAKDM4EHPGD | |
| SCHEMBL31186401 | 0.74 | ALDH1A1 (0.62) | ALDH1A1ALOX15LMNAKDM4EHPGD | |
| SCHEMBL8402762 | 0.74 | ALDH1A1 (0.62) | ALDH1A1ALOX15LMNAKDM4EHPGD | |
| Acrylic Acid SCHEMBL27869579 | 0.74 | ALDH1A1 (0.45) | ALDH1A1ALOX15LMNAKDM4EHPGD | |
| SCHEMBL547662 | 0.74 | ALDH1A1 (0.54) | ALDH1A1ALOX15LMNAKDM4EHPGD |
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 |
|---|---|---|---|---|---|---|---|
| EP-0572560-B1 | USE OF PHARMACEUTICAL COMPOUNDS IN THE TREATMENT OF SYMPTOMS OF DISORDERS RELATED TO NEUROLOGICAL DISEASES AND ETIOLOGICALLY RELATED SYMPTOMOLOGY | SHAPIRO HOWARD K (US) | 2003-01-29 | — | — | EP | claimed |
| US-4187186-A | WEAR, OXIDATION AND CORROSION RESISTANT | MOBIL OIL CORPORATION (US) | 1980-02-05 | — | — | US | disclosed |