Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.47 |
| ▸ | GLA | P06280 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 4/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | USP2 | O75604 | 4/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.44 |
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 7/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 7/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 7/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28298230 | 0.88 | KDM4E (0.51) | KDM4EGLAALDH1A1HPGDGAA | |
| SCHEMBL28298236 | 0.85 | CSNK2A1 (0.52) | KDM4EALDH1A1HPGDMEN1CYP1A2 | |
| SCHEMBL28298231 | 0.84 | KDM4E (0.54) | KDM4EGLAALDH1A1HPGDGAA | |
| SCHEMBL28299583 | 0.83 | KDM4E (0.55) | KDM4EGLAALDH1A1HPGDGAA | |
| SCHEMBL301261 | 0.83 | KDM4E (0.70) | KDM4EGLAALDH1A1HPGDGAA | |
| SCHEMBL28029226 | 0.80 | KDM4E (0.52) | KDM4EGLAALDH1A1HPGDGAA | |
| SCHEMBL28299567 | 0.79 | KDM4E (0.45) | KDM4EGLAALDH1A1HPGDGAA | |
| SCHEMBL28298233 | 0.78 | KDM4E (0.47) | KDM4EGLAALDH1A1HPGDGAA | |
| SCHEMBL28299575 | 0.78 | PIK3CD (0.46) | KDM4EGLAALDH1A1HPGDGAA | |
| SCHEMBL28298209 | 0.76 | PIK3CD (0.48) | KDM4EGLAALDH1A1HPGDMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109846884-A | With TOR kinase inhibitor for treating cancer | 西格诺药品有限公司 | 2019-06-07 | — | — | CN | disclosed |