Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.50 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 1/20 | 0.45 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 5/20 | 0.43 |
| ▸ | TP53 | P04637 | 3/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.43 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.43 |
| ▸ | PPARD | Q03181 | 1/20 | 0.42 |
| ▸ | PPARA | Q07869 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL14765475 | 0.89 | L3MBTL1 (0.55) | CYP1A2CYP1A1CYP1B1L3MBTL1ALDH1A1 | |
| SCHEMBL14765480 | 0.86 | L3MBTL1 (0.53) | L3MBTL1ALDH1A1NPSR1POLBMAPT | |
| SCHEMBL13484544 | 0.84 | PPARD (0.53) | L3MBTL1ALDH1A1NPSR1MAPTPPARD | |
| SCHEMBL14765483 | 0.83 | L3MBTL1 (0.45) | CYP1A2CYP1A1CYP1B1L3MBTL1ALDH1A1 | |
| SCHEMBL14765485 | 0.81 | BCHE (0.49) | L3MBTL1ALDH1A1NPSR1POLBMAPT | |
| SCHEMBL14765481 | 0.81 | MAPT (0.47) | L3MBTL1ALDH1A1NPSR1POLBMAPT | |
| SCHEMBL14765486 | 0.79 | L3MBTL1 (0.45) | CYP1A2CYP1A1CYP1B1L3MBTL1ALDH1A1 | |
| SCHEMBL13484549 | 0.79 | FFAR1 (0.53) | L3MBTL1ALDH1A1NPSR1MAPTFFAR1 | |
| SCHEMBL13484561 | 0.78 | ALDH1A1 (0.55) | L3MBTL1ALDH1A1NPSR1MAPTPPARD | |
| SCHEMBL14765488 | 0.76 | L3MBTL1 (0.45) | CYP1A2CYP1A1CYP1B1L3MBTL1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8394841-B2 | Compounds and methods for modulating G protein-coupled receptors | IRM LLC (BM) | 2013-03-12 | — | — | US | disclosed |