Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 6/20 | 0.50 |
| ▸ | CDK2 | P24941 | 6/20 | 0.48 |
| ▸ | CCNE1 | P24864 | 4/20 | 0.48 |
| ▸ | KCNN3 | Q9UGI6 | 8/20 | 0.40 |
| ▸ | KCNN1 | Q92952 | 2/20 | 0.40 |
| ▸ | KCNN2 | Q9H2S1 | 2/20 | 0.40 |
| ▸ | CDK9 | P50750 | 3/20 | 0.38 |
| ▸ | CDK5 | Q00535 | 3/20 | 0.38 |
| ▸ | CDK1 | P06493 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | GSK3A | P49840 | 2/20 | 0.37 |
| ▸ | CDK7 | P50613 | 2/20 | 0.37 |
| ▸ | TAOK1 | Q7L7X3 | 2/20 | 0.37 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.37 |
| ▸ | CCNT2 | O60583 | 1/20 | 0.37 |
| ▸ | BRD4 | O60885 | 1/20 | 0.37 |
| ▸ | CCNK | O75909 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL12953620 | 0.87 | GSK3B (0.47) | GSK3BCDK2CCNE1KCNN3KCNN1 | |
| SCHEMBL30356875 | 0.83 | CDK2 (0.51) | GSK3BCDK2CCNE1KCNN3KCNN1 | |
| SCHEMBL23152045 | 0.81 | GSK3B (0.48) | GSK3BCDK2CCNE1KCNN3KCNN1 | |
| SCHEMBL30872069 | 0.81 | GSK3B (0.61) | GSK3BCDK2CCNE1KCNN3KCNN1 | |
| SCHEMBL27382750 | 0.81 | GSK3B (0.54) | GSK3BCDK2CCNE1KCNN3KCNN1 | |
| SCHEMBL12953785 | 0.79 | GSK3B (0.47) | GSK3BCDK2CCNE1KCNN3KCNN1 | |
| SCHEMBL30324900 | 0.78 | GSK3B (0.43) | GSK3BCDK2CCNE1KCNN3KCNN1 | |
| SCHEMBL30083556 | 0.78 | GSK3B (0.58) | GSK3BCDK2CCNE1KCNN3KCNN1 | |
| SCHEMBL12953588 | 0.78 | NPC1 (0.48) | GSK3BCDK2CCNE1KCNN3KCNN1 | |
| SCHEMBL14545237 | 0.78 | GSK3B (0.44) | GSK3BCDK2CCNE1KCNN3KCNN1 |
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-2023059582-A1 | HETEROBIFUNCTIONAL COMPOUNDS AND THEIR USE IN TREATING DISEASE | HALDA THERAPEUTICS OPCO, INC. (US) | 2023-04-13 | — | — | WO | disclosed |