Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 4/20 | 0.49 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.49 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.49 |
| ▸ | AAK1 | Q2M2I8 | 5/20 | 0.46 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.43 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.41 |
| ▸ | BRD9 | Q9H8M2 | 1/20 | 0.39 |
| ▸ | CISD2 | Q8N5K1 | 1/20 | 0.39 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.39 |
| ▸ | CNR1 | P21554 | 1/20 | 0.39 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.39 |
| ▸ | ABL1 | P00519 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.39 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.39 |
| ▸ | BACE1 | P56817 | 1/20 | 0.39 |
| ▸ | PRKDC | P78527 | 1/20 | 0.39 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.39 |
| ▸ | IKBKE | Q14164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL198874 | 1.00 | HDAC1 (0.49) | HDAC1HDAC2HDAC3AAK1CYP17A1 | |
| SCHEMBL25212404 | 0.86 | AAK1 (0.45) | HDAC1HDAC2HDAC3AAK1CYP17A1 | |
| SCHEMBL197899 | 0.86 | HDAC2 (0.49) | HDAC1HDAC2HDAC3AAK1CYP17A1 | |
| SCHEMBL25242980 | 0.85 | IKBKB (0.44) | HDAC1HDAC2HDAC3AAK1CYP17A1 | |
| SCHEMBL25215441 | 0.85 | AAK1 (0.42) | HDAC1HDAC2HDAC3AAK1CYP17A1 | |
| SCHEMBL25214050 | 0.84 | AAK1 (0.46) | HDAC1HDAC2HDAC3AAK1CYP17A1 | |
| SCHEMBL5869075 | 0.82 | AAK1 (0.52) | AAK1CYP17A1MAP4K4CISD2 | |
| SCHEMBL23960904 | 0.81 | AAK1 (0.48) | HDAC1HDAC2HDAC3AAK1CYP17A1 | |
| SCHEMBL25214714 | 0.81 | HDAC1 (0.50) | HDAC1HDAC2HDAC3AAK1CYP17A1 | |
| SCHEMBL30474794 | 0.81 | AAK1 (0.48) | HDAC1HDAC2HDAC3AAK1CYP17A1 |
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-4441033-A1 | NOVEL HDAC INHIBITORS AND THERAPEUTIC USE THEREOF | Tango Therapeutics, Inc. (US) | 2024-10-09 | — | — | EP | disclosed |
| WO-2023102162-A1 | TGONOVEL HDAC INHIBITORS AND THERAPEUTIC USE THEREOF | TANGO THERAPEUTICS, INC. (US) | 2023-06-08 | — | — | WO | disclosed |