Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.41 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7557675 | 0.86 | DYRK1A (0.42) | ALDH1A1AKR1C3AKR1C2MAPTDYRK1A | |
| SCHEMBL5668708 | 0.82 | ALDH1A1 (0.44) | ALDH1A1AKR1C3AKR1C2MAPTDYRK1A | |
| SCHEMBL1104690 | 0.82 | ALDH1A1 (0.47) | ALDH1A1AKR1C3AKR1C2MAPTDYRK1A | |
| SCHEMBL11838725 | 0.82 | ALDH1A1 (0.47) | ALDH1A1AKR1C3AKR1C2MAPTDYRK1A | |
| SCHEMBL8859133 | 0.81 | PPARG (0.52) | ALDH1A1MAPTL3MBTL1NPSR1TSHR | |
| SCHEMBL11397144 | 0.81 | SLC6A2 (0.51) | ALDH1A1SLC6A2SLC6A4SMN1; SMN2 | |
| SCHEMBL27285377 | 0.80 | ALDH1A1 (0.46) | ALDH1A1AKR1C3AKR1C2MAPTDYRK1A | |
| SCHEMBL17541514 | 0.80 | ALDH1A1 (0.46) | ALDH1A1AKR1C3AKR1C2MAPTDYRK1A | |
| SCHEMBL364427 | 0.80 | ALDH1A1 (0.42) | ALDH1A1AKR1C3AKR1C2MAPTDYRK1A | |
| SCHEMBL8177797 | 0.79 | CYP1A2 (0.39) | ALDH1A1AKR1C3AKR1C2GAAL3MBTL1 |
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-0649417-B1 | IMPROVED CHEMILUMINESCENT 1,2-DIOXETANES | TROPIX INC (US) | 2001-09-19 | — | — | EP | disclosed |
| US-5840919-A | SPIROADAMANTYL 1,2-DIOXETANES CHARACTERIZED BY SUBSTITUENT ON AROMATIC RING IN ADDITION TO META-SUBSTITUTED ENZYME-LABILE GROUP | TROPIX, INC. (US) | 1998-11-24 | — | — | US | disclosed |