Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.52 |
| ▸ | BCHE | P06276 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | RAD52 | P43351 | 1/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.42 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.42 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL19903722 | 0.89 | CYP2D6 (0.46) | CYP3A4CYP2D6CYP1A2KDM4EBCHE | |
| SCHEMBL3688386 | 0.85 | CYP3A4 (0.56) | CYP3A4CYP2D6CYP1A2KDM4EBCHE | |
| SCHEMBL3688385 | 0.85 | CYP3A4 (0.56) | CYP3A4CYP2D6CYP1A2KDM4EBCHE | |
| SCHEMBL31441430 | 0.84 | CYP3A4 (0.52) | CYP3A4CYP2D6CYP1A2KDM4EBCHE | |
| SCHEMBL31540532 | 0.83 | CYP3A4 (0.58) | CYP3A4CYP2D6CYP1A2KDM4EBCHE | |
| SCHEMBL31035277 | 0.82 | CYP3A4 (0.53) | CYP3A4CYP2D6CYP1A2KDM4EBCHE | |
| SCHEMBL27564412 | 0.81 | BCHE (0.60) | CYP3A4CYP2D6CYP1A2KDM4EBCHE | |
| SCHEMBL31463799 | 0.80 | KDM4E (0.40) | CYP3A4CYP2D6CYP1A2KDM4EBCHE | |
| SCHEMBL18379070 | 0.80 | CYP3A4 (0.51) | CYP3A4CYP2D6CYP1A2KDM4EBCHE | |
| SCHEMBL29033122 | 0.79 | CYP3A4 (0.50) | CYP3A4CYP2D6CYP1A2KDM4EBCHE |
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-2023064218-A1 | TYRO3 INHIBITORS | Halia Therapeutics, Inc. (US) | 2023-04-20 | — | — | WO | disclosed |