Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | TPSAB1 | Q15661 | 2/20 | 0.35 |
| ▸ | TPSD1 | Q9BZJ3 | 2/20 | 0.35 |
| ▸ | TPSG1 | Q9NRR2 | 2/20 | 0.35 |
| ▸ | GABRP | O00591 | 2/20 | 0.34 |
| ▸ | GABRD | O14764 | 2/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.34 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.34 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.34 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.34 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.34 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.34 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.34 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.34 |
| ▸ | GABRA4 | P48169 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3621906 | 1.00 | HDAC6 (0.38) | HDAC6HDAC1HDAC2MEN1GAA | |
| SCHEMBL3619491 | 0.97 | HDAC6 (0.38) | HDAC6HDAC1HDAC2MEN1GAA | |
| SCHEMBL3662436 | 0.84 | CPB2 (0.40) | HDAC6HDAC1HDAC2MEN1GAA | |
| SCHEMBL1022347 | 0.84 | CPB2 (0.40) | HDAC6HDAC1HDAC2MEN1GAA | |
| SCHEMBL3662433 | 0.84 | CPB2 (0.40) | HDAC6HDAC1HDAC2MEN1GAA | |
| SCHEMBL7416589 | 0.83 | CPB2 (0.42) | HDAC6HDAC1HDAC2MEN1GAA | |
| SCHEMBL2211497 | 0.83 | CPB2 (0.42) | HDAC6HDAC1HDAC2MEN1GAA | |
| SCHEMBL1039473 | 0.83 | CPB2 (0.42) | HDAC6HDAC1HDAC2MEN1GAA | |
| SCHEMBL20743469 | 0.83 | MEN1 (0.38) | HDAC6HDAC1HDAC2MEN1GAA | |
| SCHEMBL20743467 | 0.83 | MEN1 (0.38) | HDAC6HDAC1HDAC2MEN1GAA |
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-2009042094-A2 | HIV PROTEASE INHIBITORS | MERCK & CO., INC. (US) | 2009-04-02 | — | — | WO | disclosed |