Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.35 |
| ▸ | KAT6A | Q92794 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | BACE1 | P56817 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.32 |
| ▸ | FPR2 | P25090 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL24036886 | 0.90 | MEN1 (0.34) | KAT6AALDH1A1BACE1HPGDKMT2A | |
| SCHEMBL25753621 | 0.90 | MEN1 (0.34) | KAT6AALDH1A1BACE1HPGDKMT2A | |
| SCHEMBL28957391 | 0.88 | BACE1 (0.34) | NPSR1BACE1 | |
| SCHEMBL29725911 | 0.88 | BACE1 (0.34) | NPSR1BACE1 | |
| SCHEMBL31089151 | 0.88 | TSHR (0.39) | NPSR1ADORA3SMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL29725964 | 0.86 | BACE1 (0.34) | NPSR1BACE1 | |
| SCHEMBL31088888 | 0.86 | BACE1 (0.33) | BACE1 | |
| SCHEMBL25819422 | 0.86 | BACE1 (0.34) | NPSR1BACE1 | |
| SCHEMBL23259944 | 0.86 | BACE1 (0.34) | NPSR1BACE1 | |
| SCHEMBL30972783 | 0.85 | BACE1 (0.35) | NPSR1BACE1 |
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-2024175907-A1 | MACROCYCLIC ALPHA4BETA7 INTEGRIN INHIBITORS | C4X DISCOVERY LIMITED (GB) | 2024-08-29 | — | — | WO | disclosed |