Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.50 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL6822002 | 0.89 | ALDH1A1 (0.52) | ALDH1A1CYP1A2CYP3A4CYP2C19PDE7A | |
| SCHEMBL5718757 | 0.83 | ALDH1A1 (0.47) | ALDH1A1CYP1A2CYP3A4CYP2C19PDE7A | |
| SCHEMBL5673785 | 0.81 | ALDH1A1 (0.60) | ALDH1A1CYP1A2CYP3A4CYP2C19MAPT | |
| SCHEMBL2593397 | 0.81 | ALDH1A1 (0.60) | ALDH1A1CYP1A2CYP3A4CYP2C19MAPT | |
| SCHEMBL2033918 | 0.81 | KDM4E (0.53) | ALDH1A1MEN1KMT2AMAPTPOLB | |
| SCHEMBL2936661 | 0.81 | ALDH1A1 (0.78) | ALDH1A1MEN1KMT2APOLBATM | |
| SCHEMBL2593349 | 0.80 | CYP1A2 (0.50) | ALDH1A1CYP1A2CYP3A4CYP2C19MEN1 | |
| SCHEMBL29750606 | 0.79 | TTR (0.64) | ALDH1A1CYP1A2CYP3A4CYP2C19MEN1 | |
| SCHEMBL704754 | 0.79 | TTR (0.64) | ALDH1A1CYP1A2CYP3A4CYP2C19MEN1 | |
| SCHEMBL16428849 | 0.79 | ALDH1A1 (0.51) | ALDH1A1CYP1A2CYP3A4CYP2C19MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007047575-A2 | PHARMACOLOGICAL TREATMENTS FOR SLEEP-RELATED BREATHING DISORDERS | THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) | 2007-04-26 | — | — | WO | disclosed |