Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | FOLH1 | Q04609 | 4/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | TPSAB1 | Q15661 | 2/20 | 0.36 |
| ▸ | TPSD1 | Q9BZJ3 | 2/20 | 0.36 |
| ▸ | TPSG1 | Q9NRR2 | 2/20 | 0.36 |
| ▸ | ENPEP | Q07075 | 2/20 | 0.33 |
| ▸ | GSTK1 | Q9Y2Q3 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | BHMT | Q93088 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL20514700 | 1.00 | MEN1 (0.37) | MEN1GAAKMT2AFOLH1HDAC6 | |
| SCHEMBL14150478 | 0.94 | HDAC1 (0.41) | MEN1GAAKMT2AHDAC6HDAC1 | |
| SCHEMBL3626322 | 0.90 | CYP1A2 (0.38) | MEN1GAAKMT2AFOLH1HDAC6 | |
| SCHEMBL26129394 | 0.90 | CYP1A2 (0.38) | MEN1GAAKMT2AFOLH1HDAC6 | |
| SCHEMBL26129393 | 0.90 | CYP1A2 (0.38) | MEN1GAAKMT2AFOLH1HDAC6 | |
| SCHEMBL5970436 | 0.86 | CA14 (0.41) | MEN1GAAKMT2AHDAC6HDAC1 | |
| SCHEMBL20743469 | 0.85 | MEN1 (0.38) | MEN1GAAKMT2AHDAC6HDAC1 | |
| SCHEMBL20743467 | 0.85 | MEN1 (0.38) | MEN1GAAKMT2AHDAC6HDAC1 | |
| SCHEMBL1022347 | 0.84 | CPB2 (0.40) | MEN1GAAKMT2AHDAC6HDAC1 | |
| SCHEMBL3662433 | 0.84 | CPB2 (0.40) | MEN1GAAKMT2AHDAC6HDAC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2632895-B1 | HIV PROTEASE INHIBITORS | MERCK CANADA INC (CA) | 2018-10-03 | — | — | EP | disclosed |