Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 11/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 11/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 11/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 9/20 | 0.39 |
| ▸ | CLK4 | Q9HAZ1 | 8/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 6/20 | 0.39 |
| ▸ | LMNA | P02545 | 5/20 | 0.39 |
| ▸ | USP2 | O75604 | 5/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.35 |
| ▸ | TSHR | P16473 | 6/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | RET | P07949 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL24345334 | 0.94 | CYP1A2 (0.41) | CYP1A2CYP3A4CYP2C19CYP2D6CLK4 | |
| SCHEMBL21801374 | 0.93 | CYP1A2 (0.38) | CYP1A2CYP3A4CYP2C19CYP2D6CLK4 | |
| SCHEMBL21801377 | 0.92 | CYP1A2 (0.38) | CYP1A2CYP3A4CYP2C19CYP2D6CLK4 | |
| SCHEMBL24345188 | 0.89 | MAPT (0.43) | CYP1A2CYP3A4CYP2C19CYP2D6CLK4 | |
| SCHEMBL21801365 | 0.88 | MAPT (0.41) | CYP1A2CYP3A4CYP2C19CYP2D6CLK4 | |
| SCHEMBL28650199 | 0.88 | CYP1A2 (0.38) | CYP1A2CYP3A4CYP2C19CYP2D6CLK4 | |
| SCHEMBL21801581 | 0.88 | MAPT (0.40) | CYP1A2CYP3A4CYP2C19CYP2D6CLK4 | |
| SCHEMBL21801583 | 0.84 | MAPT (0.40) | CYP1A2CYP3A4CYP2C19CYP2D6CLK4 | |
| SCHEMBL28655516 | 0.84 | CYP1A2 (0.39) | CYP1A2CYP3A4CYP2C19CYP2D6CLK4 | |
| SCHEMBL29681666 | 0.79 | CYP1A2 (0.42) | CYP1A2CYP3A4CYP2C19CYP2D6CLK4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3849986-B1 | FUSED HETEROCYCLIC COMPOUNDS AS RET KINASE INHIBITORS | ARRAY BIOPHARMA INC (US) | 2022-06-08 | — | — | EP | disclosed |