Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.54 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.46 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | BCHE | P06276 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | FUCA1 | P04066 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL25358242 | 1.00 | SIGMAR1 (0.54) | SIGMAR1S1PR1S1PR5ATML3MBTL1 | |
| SCHEMBL29030940 | 0.86 | S1PR1 (0.48) | S1PR1S1PR5TSHRFUCA1 | |
| SCHEMBL29030939 | 0.86 | S1PR1 (0.48) | S1PR1S1PR5TSHRFUCA1 | |
| SCHEMBL844250 | 0.83 | SIGMAR1 (0.48) | SIGMAR1S1PR1S1PR5ATML3MBTL1 | |
| SCHEMBL844251 | 0.83 | SIGMAR1 (0.48) | SIGMAR1S1PR1S1PR5ATML3MBTL1 | |
| SCHEMBL844252 | 0.83 | SIGMAR1 (0.48) | SIGMAR1S1PR1S1PR5ATML3MBTL1 | |
| SCHEMBL2471861 | 0.83 | SIGMAR1 (0.50) | SIGMAR1S1PR1S1PR5ATML3MBTL1 | |
| SCHEMBL6671433 | 0.82 | SIGMAR1 (0.47) | SIGMAR1S1PR1S1PR5ATML3MBTL1 | |
| SCHEMBL22874318 | 0.82 | SIGMAR1 (0.49) | SIGMAR1S1PR1S1PR5ATML3MBTL1 | |
| SCHEMBL20875290 | 0.81 | S1PR5 (0.54) | SIGMAR1S1PR1S1PR5FUCA1 |
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-2023151473-A1 | KHK INHIBITOR, PREPARATION METHOD THEREFOR AND USE THEREOF | 上海研健新药研发有限公司 | 2023-08-17 | — | — | WO | disclosed |