Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FAAH | O00519 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | PREP | P48147 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | CNR1 | P21554 | 1/20 | 0.39 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.37 |
| ▸ | ATF4 | P18848 | 3/20 | 0.37 |
| ▸ | MLNR | O43193 | 3/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HRH1 | P35367 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3354392 | 0.86 | EPHX2 (0.42) | EPHX2HTTATF4MLNRADRB2 | |
| SCHEMBL13331466 | 0.83 | EPHX2 (0.44) | EPHX2CNR1ATF4MLNRADRB2 | |
| SCHEMBL13330704 | 0.78 | AKR1B1 (0.48) | AKR1B1MEN1KMT2AALDH1A1RAB9A | |
| SCHEMBL3358756 | 0.73 | AKR1B1 (0.46) | AKR1B1POLBALDH1A1 | |
| SCHEMBL3354415 | 0.72 | ALDH1A1 (0.37) | PREPAKR1B1ATF4ALDH1A1 | |
| SCHEMBL3356066 | 0.71 | ALDH1A1 (0.35) | PREPHTTATF4CYP3A4MEN1 | |
| SCHEMBL13308313 | 0.70 | AKR1B1 (0.44) | AKR1B1POLBALDH1A1 | |
| SCHEMBL3354939 | 0.69 | CCR1 (0.37) | MAPTHTTKMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL13330848 | 0.69 | ALDH1A1 (0.34) | PREPATF4ALDH1A1 | |
| SCHEMBL3356896 | 0.68 | ALDH1A1 (0.51) | MAPTHTTMEN1POLBKMT2A |
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-2010068881-A1 | NOVEL BENZODIOXANE AND BENZOXAZINE DERIVATIVES USEFUL AS CC CHEMOKINE RECEPTOR LIGANDS | FOREST LABORATORIES HOLDINGS LIMITED (BM) | 2010-06-17 | — | — | WO | disclosed |