Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | KIF11 | P52732 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | KCNN4 | O15554 | 6/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3118068 | 0.80 | MAPK1 (0.42) | MAPK1ALDH1A1ALOX15KCNN4TSHR | |
| SCHEMBL4666868 | 0.78 | MAPK1 (0.46) | MAPK1ALDH1A1ALOX15KCNN4TSHR | |
| SCHEMBL10881380 | 0.78 | MAPK1 (0.41) | MAPK1ALDH1A1ALOX15KCNN4TSHR | |
| SCHEMBL14292070 | 0.78 | MAPK1 (0.46) | MAPK1ALDH1A1ALOX15KCNN4TSHR | |
| SCHEMBL28637909 | 0.76 | HTR7 (0.30) | — | |
| SCHEMBL29098884 | 0.75 | TSHR (0.42) | MAPK1KIF11ALDH1A1ALOX15KCNN4 | |
| SCHEMBL7041483 | 0.75 | MAPK1 (0.38) | MAPK1ALDH1A1ALOX15KCNN4TSHR | |
| SCHEMBL7180018 | 0.73 | KCNN4 (0.38) | MAPK1KIF11ALDH1A1ALOX15KCNN4 | |
| SCHEMBL5701690 | 0.73 | MAPK1 (0.37) | MAPK1ALDH1A1ALOX15KCNN4TSHR | |
| SCHEMBL18216888 | 0.73 | CYP2D6 (0.37) | MAPK1ALDH1A1ALOX15KCNN4TSHR |
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-1917234-A1 | TRITYLATION REACTIONS BASED ON METALLIC CATALYSIS | Universita'Degli Studi di Roma "La Sapienza" (IT) | 2008-05-07 | — | — | EP | disclosed |
| WO-2007009944-A1 | TRITYLATION REACTIONS BASED ON METALLIC CATALYSIS | Università degli Studi di Roma 'La Sapienza' (IT) | 2007-01-25 | — | — | WO | disclosed |