Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 16/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.32 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL30015011 | 1.00 | GSK3B (0.35) | GSK3BLMNADYRK1ACYP2D6CYP3A4 | |
| SCHEMBL24698700 | 0.85 | MTOR (0.38) | TRPV1 | |
| SCHEMBL30017019 | 0.85 | MTOR (0.38) | TRPV1 | |
| SCHEMBL30015925 | 0.84 | KCNH2 (0.36) | LMNADYRK1AALDH1A1CREBBPTRPV1 | |
| SCHEMBL24699075 | 0.84 | KCNH2 (0.36) | LMNADYRK1AALDH1A1CREBBPTRPV1 | |
| SCHEMBL24698853 | 0.83 | ALDH1A1 (0.37) | LMNACYP2D6CYP3A4ALDH1A1TRPV1 | |
| SCHEMBL24699490 | 0.82 | KDM4E (0.38) | GSK3BLMNAALDH1A1 | |
| SCHEMBL24698056 | 0.80 | PIK3CA (0.35) | ALDH1A1 | |
| SCHEMBL24697573 | 0.79 | P2RX7 (0.34) | TRPV1 | |
| SCHEMBL24699352 | 0.79 | BMPR1A (0.35) | ALDH1A1 |
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-2022212194-A1 | KHK INHIBITORS | GILEAD SCIENCES, INC. (US) | 2022-10-06 | — | — | WO | disclosed |