Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | YAP1 | P46937 | 3/20 | 0.42 |
| ▸ | BCHE | P06276 | 4/20 | 0.42 |
| ▸ | HTR6 | P50406 | 4/20 | 0.42 |
| ▸ | PSMB5 | P28074 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 2/20 | 0.41 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.41 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.41 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.41 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.41 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.39 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.39 |
| ▸ | CTSS | P25774 | 1/20 | 0.39 |
| ▸ | CTSK | P43235 | 1/20 | 0.39 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL29269481 | 1.00 | YAP1 (0.42) | YAP1BCHEHTR6PSMB5LMNA | |
| SCHEMBL29269479 | 1.00 | YAP1 (0.42) | YAP1BCHEHTR6PSMB5LMNA | |
| SCHEMBL29269320 | 0.92 | BCHE (0.43) | YAP1BCHEHTR6PSMB5ACHE | |
| SCHEMBL30283202 | 0.92 | BCHE (0.43) | YAP1BCHEHTR6PSMB5ACHE | |
| SCHEMBL29269318 | 0.92 | BCHE (0.43) | YAP1BCHEHTR6PSMB5ACHE | |
| SCHEMBL29269492 | 0.92 | YAP1 (0.42) | YAP1BCHEHTR6ACHECACNA1F | |
| SCHEMBL30283502 | 0.92 | YAP1 (0.42) | YAP1BCHEHTR6ACHECACNA1F | |
| SCHEMBL29269489 | 0.92 | YAP1 (0.42) | YAP1BCHEHTR6ACHECACNA1F | |
| SCHEMBL29269487 | 0.89 | BCHE (0.44) | YAP1BCHEHTR6ACHECACNA1F | |
| SCHEMBL29269486 | 0.89 | BCHE (0.44) | YAP1BCHEHTR6ACHECACNA1F |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4301736-A1 | MACROCYCLIC COMPOUNDS AS PROTEASOME SUBUNIT BETA TYPE-5 INHIBITORS | Lead Discovery Center GmbH (DE) | 2024-01-10 | — | — | EP | disclosed |
| WO-2023046939-A1 | MACROCYCLIC COMPOUNDS AS PROTEASOME SUBUNIT BETA TYPE-5 INHIBITORS | LEAD DISCOVERY CENTER GMBH (DE) | 2023-03-30 | — | — | WO | disclosed |