Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.55 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | GPBAR1 | Q8TDU6 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | CYSLTR1 | Q9Y271 | 4/20 | 0.42 |
| ▸ | CYSLTR2 | Q9NS75 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.41 |
| ▸ | MGAM | O43451 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL502039 | 0.86 | CYP1A2 (0.53) | CYP1A2MAPTALDH1A1GAAGPBAR1 | |
| SCHEMBL29430134 | 0.86 | CYP1A2 (0.53) | CYP1A2MAPTALDH1A1GAAGPBAR1 | |
| SCHEMBL502040 | 0.86 | CYP1A2 (0.53) | CYP1A2MAPTALDH1A1GAAGPBAR1 | |
| SCHEMBL839033 | 0.86 | CYP1A2 (0.53) | CYP1A2MAPTALDH1A1GAAGPBAR1 | |
| SCHEMBL19072314 | 0.84 | CYP1A2 (0.58) | CYP1A2MAPTALDH1A1GAAGPBAR1 | |
| SCHEMBL27484851 | 0.84 | CYP1A2 (0.51) | CYP1A2MAPTALDH1A1GAAGPBAR1 | |
| SCHEMBL6496060 | 0.84 | CYP1A2 (0.51) | CYP1A2MAPTALDH1A1GAAGPBAR1 | |
| Hydrochloric Acid SCHEMBL6496063 | 0.82 | CYP1A2 (0.50) | CYP1A2MAPTALDH1A1GAAGPBAR1 | |
| Hydrochloric Acid SCHEMBL6496049 | 0.82 | CYP1A2 (0.50) | CYP1A2MAPTALDH1A1GAAGPBAR1 | |
| SCHEMBL12424092 | 0.79 | CYP1A2 (0.52) | CYP1A2MAPTALDH1A1GAAGPBAR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3052121-B1 | WNT COMPOSITIONS AND METHODS FOR PURIFICATION | UNIV LELAND STANFORD JUNIOR (US) | 2023-02-22 | — | — | EP | disclosed |
| WO-2012173846-A2 | PEPTIDOMIMETIC MACROCYCLES | AILERON THERAPEUTICS, INC. (US) | 2012-12-20 | — | — | WO | disclosed |
| WO-2012021875-A1 | PEPTIDOMIMETIC MACROCYCLES WITH TRIAZOLE LINKERS | AILERON THERAPEUTICS, INC. (US) | 2012-02-16 | — | — | WO | disclosed |