Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | BACE1 | P56817 | 1/20 | 0.38 |
| ▸ | LCK | P06239 | 6/20 | 0.37 |
| ▸ | DGAT1 | O75907 | 2/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | ACMSD | Q8TDX5 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | ATR | Q13535 | 1/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL31089059 | 0.75 | LCK (0.54) | LCKCA12CA1CA9ATR | |
| SCHEMBL17528556 | 0.73 | LCK (0.49) | LCKCA12CA1CA9ATR | |
| SCHEMBL3042736 | 0.72 | LCK (0.43) | LCKCA12CA1CA9ATR | |
| SCHEMBL31088710 | 0.72 | CYP2C9 (0.44) | KMT2A | |
| SCHEMBL3131919 | 0.71 | LCK (0.60) | LCKCA12CA1CA9LMNA | |
| SCHEMBL20865564 | 0.71 | LCK (0.50) | LCKCA12CA1CA9ATR | |
| SCHEMBL5190565 | 0.70 | KMO (0.47) | KMT2ANPSR1 | |
| SCHEMBL28561049 | 0.70 | LCK (0.41) | LCKCA12CA1CA9ATR | |
| SCHEMBL4568352 | 0.69 | LMNA (0.47) | DGAT1CA12CA1CA9KMT2A | |
| SCHEMBL2997409 | 0.69 | LCK (0.52) | LCKCA12CA1CA9ATR |
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 |