Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.38 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 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 | |
|---|---|---|---|---|
| SCHEMBL372366 | 0.83 | KIF11 (0.49) | KIF11GAAL3MBTL1KMT2ATDP1 | |
| SCHEMBL25340140 | 0.82 | OPRM1 (0.46) | KIF11GAAL3MBTL1LMNAHTT | |
| SCHEMBL7514059 | 0.81 | KCNN4 (0.50) | KIF11GAAL3MBTL1LMNAHTT | |
| SCHEMBL16586535 | 0.79 | CYP1A2 (0.47) | KIF11GAAKMT2AMAPTALDH1A1 | |
| SCHEMBL28416200 | 0.78 | CYP1A2 (0.46) | KIF11GAAHTTKMT2AALDH1A1 | |
| SCHEMBL28419010 | 0.78 | CYP1A2 (0.46) | KIF11GAAHTTKMT2AALDH1A1 | |
| SCHEMBL28419024 | 0.78 | CYP1A2 (0.46) | KIF11GAAHTTKMT2AALDH1A1 | |
| SCHEMBL3664383 | 0.78 | CYP1A2 (0.46) | KIF11GAAHTTKMT2AALDH1A1 | |
| SCHEMBL3664564 | 0.78 | CYP1A2 (0.46) | KIF11GAAHTTKMT2AALDH1A1 | |
| SCHEMBL17568782 | 0.74 | AR (0.30) | — |
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-1699455-B1 | HETEROCYCLIC ASPARTYL PROTEASE INHIBITORS | MERCK SHARP & DOHME (US) | 2013-05-08 | — | — | EP | disclosed |