Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.55 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | PPARA | Q07869 | 2/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.44 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.44 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.44 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.44 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL5191886 | 0.89 | TDP1 (0.52) | L3MBTL1GAATDP1TSHRTP53 | |
| SCHEMBL16245586 | 0.84 | PPARA (0.63) | L3MBTL1GAAPPARAHDAC1HDAC3 | |
| SCHEMBL8117338 | 0.84 | TDP1 (0.50) | L3MBTL1GAATDP1TSHR | |
| SCHEMBL28655996 | 0.83 | MEN1 (0.53) | L3MBTL1GAATDP1HDAC1HDAC3 | |
| SCHEMBL24935937 | 0.82 | GAA (0.58) | L3MBTL1GAAPPARAHDAC1HDAC3 | |
| SCHEMBL25794785 | 0.82 | NR5A1 (0.62) | L3MBTL1GAATSHRHDAC1HDAC3 | |
| SCHEMBL17265696 | 0.82 | PPARA (0.61) | L3MBTL1PPARAHDAC1HDAC3HDAC4 | |
| SCHEMBL25794749 | 0.82 | NR5A1 (0.62) | L3MBTL1GAATSHRHDAC1HDAC3 | |
| SCHEMBL839412 | 0.82 | PPARA (0.61) | L3MBTL1PPARAHDAC1HDAC3HDAC4 | |
| SCHEMBL15887764 | 0.82 | NR5A1 (0.62) | L3MBTL1GAATSHRHDAC1HDAC3 |
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-2994471-B1 | MACROCYCLES AS KINASE INHIBITORS | MERCK PATENT GMBH (DE) | 2017-05-17 | — | — | EP | disclosed |