Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TTR | P02766 | 9/20 | 0.84 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.84 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.84 |
| ▸ | MEN1 | O00255 | 2/20 | 0.84 |
| ▸ | LMNA | P02545 | 2/20 | 0.84 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.84 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.84 |
| ▸ | MAPT | P10636 | 2/20 | 0.84 |
| ▸ | HPGD | P15428 | 2/20 | 0.84 |
| ▸ | CASP7 | P55210 | 2/20 | 0.84 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.84 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.84 |
| ▸ | FTO | Q9C0B1 | 2/20 | 0.84 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.84 |
| ▸ | USP2 | O75604 | 1/20 | 0.84 |
| ▸ | TP53 | P04637 | 1/20 | 0.84 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.84 |
| ▸ | HTR1A | P08908 | 1/20 | 0.84 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.84 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.84 |
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 | |
|---|---|---|---|---|
| Diacerein SCHEMBL5051685 | 0.92 | TTR (1.00) | TTRALDH1A1KDM4EMEN1LMNA | |
| Diacerein SCHEMBL25784 | 0.92 | TTR (1.00) | TTRALDH1A1KDM4EMEN1LMNA | |
| Diacerein SCHEMBL29423907 | 0.92 | TTR (1.00) | TTRALDH1A1KDM4EMEN1LMNA | |
| Diacerein SCHEMBL29944894 | 0.92 | TTR (1.00) | TTRALDH1A1KDM4EMEN1LMNA | |
| Diacerein SCHEMBL7438555 | 0.91 | TTR (0.97) | TTRALDH1A1KDM4EMEN1LMNA | |
| Diacerein SCHEMBL5078956 | 0.91 | TTR (0.97) | TTRALDH1A1KDM4EMEN1LMNA | |
| Diacerein SCHEMBL787907 | 0.91 | TTR (0.97) | TTRALDH1A1KDM4EMEN1LMNA | |
| Diacerein SCHEMBL2326532 | 0.87 | TTR (0.86) | TTRALDH1A1KDM4EMEN1LMNA | |
| SCHEMBL3292601 | 0.86 | TTR (0.72) | TTRALDH1A1KDM4EMEN1LMNA | |
| SCHEMBL30610028 | 0.84 | TTR (0.80) | TTRALDH1A1KDM4EMEN1LMNA |
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-3851104-A1 | SYNERGIC PHARMACEUTICAL COMBINATION OF A SELECTIVE INHIBITOR OF CYCLOOXYGENASE-2 AND AN ANTHRAQUINONE DERIVATIVE | Amézcua Amézcua, Federico (MX) | 2021-07-21 | — | — | EP | disclosed |