Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 7/20 | 0.38 |
| ▸ | CLK4 | Q9HAZ1 | 5/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 3/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | REN | P00797 | 1/20 | 0.35 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | TYMS | P04818 | 1/20 | 0.33 |
| ▸ | AHR | P35869 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL3421160 | 0.88 | CYP1A2 (0.43) | CYP1A2CLK4CYP3A4CYP2D6HSD17B10 | |
| SCHEMBL3419882 | 0.87 | CYP1A2 (0.42) | CYP1A2CLK4CYP3A4CYP2D6HSD17B10 | |
| SCHEMBL2882792 | 0.87 | CYP1A2 (0.42) | CYP1A2CLK4CYP3A4CYP2D6HSD17B10 | |
| SCHEMBL11786632 | 0.85 | CYP1A2 (0.35) | CYP1A2CLK4CYP3A4CYP2D6HSD17B10 | |
| SCHEMBL8077079 | 0.84 | CYP1A2 (0.34) | CYP1A2CLK4CYP3A4CYP2D6HSD17B10 | |
| SCHEMBL13464453 | 0.79 | AURKA (0.33) | CYP1A2CYP3A4HSD17B10USP2TSHR | |
| SCHEMBL8742321 | 0.77 | — | — | |
| SCHEMBL10330637 | 0.77 | TDP1 (0.39) | CYP1A2CLK4CYP3A4CYP2D6HSD17B10 | |
| SCHEMBL8997093 | 0.77 | PTGES (0.36) | CYP1A2CYP3A4CYP2C19MAPK1ALDH1A1 | |
| SCHEMBL12200945 | 0.77 | CDK4 (0.37) | CYP1A2CYP2D6HSD17B10CYP2C19ALOX15 |
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-2022255135-A1 | PHTHALOCYANINE COMPOUND | DIC株式会社 | 2022-12-08 | — | — | WO | disclosed |