Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCRTR1 | O43613 | 2/20 | 0.36 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.34 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.34 |
| ▸ | RELA | Q04206 | 2/20 | 0.34 |
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.34 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.34 |
| ▸ | TAS1R2 | Q8TE23 | 2/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | BRD9 | Q9H8M2 | 1/20 | 0.33 |
| ▸ | BTK | Q06187 | 1/20 | 0.33 |
| ▸ | CCR1 | P32246 | 1/20 | 0.33 |
| ▸ | F2R | P25116 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | F11 | P03951 | 1/20 | 0.32 |
| ▸ | KDM1A | O60341 | 1/20 | 0.32 |
| ▸ | F2 | P00734 | 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 | |
|---|---|---|---|---|
| SCHEMBL27280455 | 0.89 | HCRTR1 (0.35) | HCRTR1HCRTR2PDE4BNFKB1NFKB2 | |
| SCHEMBL27280550 | 0.86 | HCRTR1 (0.34) | HCRTR1HCRTR2PDE4BNFKB1NFKB2 | |
| SCHEMBL30954373 | 0.85 | CCR1 (0.38) | HCRTR1HCRTR2PDE4BNFKB1NFKB2 | |
| SCHEMBL27280636 | 0.85 | RET (0.32) | HCRTR1HCRTR2PDE4BTAS1R3TAS1R1 | |
| SCHEMBL30954378 | 0.78 | MAPK1 (0.34) | HCRTR1HCRTR2PDE4BHDAC4HDAC6 | |
| SCHEMBL30954377 | 0.78 | MAPK1 (0.34) | HCRTR1HCRTR2PDE4BHDAC4HDAC6 | |
| SCHEMBL27280638 | 0.78 | MAPK1 (0.34) | HCRTR1HCRTR2PDE4BHDAC4HDAC6 | |
| SCHEMBL12290387 | 0.75 | PDE4B (0.38) | HCRTR1HCRTR2PDE4BTAS1R3TAS1R1 | |
| SCHEMBL25937283 | 0.74 | HCRTR1 (0.40) | HCRTR1HCRTR2PDE4BHDAC4HDAC6 | |
| SCHEMBL25937280 | 0.74 | HCRTR1 (0.40) | HCRTR1HCRTR2PDE4BHDAC4HDAC6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024118564-A1 | CHECKPOINT KINASE 1 (CHK1) INHIBITORS AND USES THEREOF | BOUNDLESS BIO, INC. (US) | 2024-06-06 | — | — | WO | disclosed |
| WO-2024118564-A1 | CHECKPOINT KINASE 1 (CHK1) INHIBITORS AND USES THEREOF | BOUNDLESS BIO, INC. (US) | 2024-06-06 | — | — | WO | disclosed |