Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 8/20 | 0.43 |
| ▸ | FAAH | O00519 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL17028837 | 0.89 | ALDH1A1 (0.43) | ALDH1A1KDM4ELMNACYP2D6POLB | |
| SCHEMBL17028827 | 0.85 | MEN1 (0.39) | ALDH1A1KDM4EFAAHLMNAPOLB | |
| SCHEMBL17028815 | 0.85 | ALDH1A1 (0.47) | ALDH1A1KDM4ELMNACYP2D6POLB | |
| SCHEMBL17028841 | 0.84 | FAAH (0.42) | ALDH1A1KDM4EFAAHLMNAPOLB | |
| SCHEMBL17028818 | 0.84 | ALDH1A1 (0.46) | ALDH1A1KDM4ELMNACYP2D6KMT2A | |
| SCHEMBL17028844 | 0.83 | ALDH1A1 (0.52) | ALDH1A1KDM4ELMNACYP2D6POLB | |
| SCHEMBL17028840 | 0.82 | L3MBTL1 (0.40) | ALDH1A1KDM4EFAAHLMNAPOLB | |
| SCHEMBL17028825 | 0.82 | ALDH1A1 (0.43) | ALDH1A1KDM4ELMNACYP2D6POLB | |
| SCHEMBL17028816 | 0.81 | ALDH1A1 (0.49) | ALDH1A1KDM4ELMNAPOLBHTT | |
| SCHEMBL17028828 | 0.81 | ALDH1A1 (0.48) | ALDH1A1KDM4ELMNACYP2D6POLB |
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-3107542-A1 | PROCESS FOR PREPARING N-BENZYL-3-HYDROXY-4-SUBSTITUTED-PYRIDIN-2-(1H)-ONES | Aerpio Therapeutics, Inc. (US) | 2016-12-28 | — | — | EP | disclosed |
| WO-2015126860-A1 | PROCESS FOR PREPARING N-BENZYL-3-HYDROXY-4-SUBSTITUTED-PYRIDIN-2-(1H)-ONES | AERPIO THERAPEUTICS, INC. (US) | 2015-08-27 | — | — | WO | disclosed |