Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20031230 | 0.75 | NOTUM (0.30) | — | |
| SCHEMBL3654657 | 0.72 | — | — | |
| SCHEMBL12812508 | 0.60 | TSHR (0.33) | ALDH1A1TSHR | |
| SCHEMBL21161318 | 0.59 | CES2 (0.31) | — | |
| SCHEMBL12808599 | 0.59 | — | — | |
| SCHEMBL11571253 | 0.58 | TSHR (0.39) | TSHR | |
| SCHEMBL17503288 | 0.58 | — | — | |
| SCHEMBL22290 | 0.58 | — | — | |
| Acetic Acid SCHEMBL8598462 | 0.57 | TSHR (0.47) | TSHR | |
| SCHEMBL2283765 | 0.56 | ALDH1A1 (0.34) | HCAR2ALDH1A1 |
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-2023084397-A1 | MACROCYCLIC COMPOUNDS AND DIAGNOSTIC USES THEREOF | JANSSEN BIOTECH, INC. (US) | 2023-05-19 | — | — | WO | disclosed |