Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | MRGPRX4 | Q96LA9 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | PLG | P00747 | 1/20 | 0.42 |
| ▸ | PLAU | P00749 | 1/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.42 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL30656512 | 1.00 | KMT2A (0.45) | KMT2AMRGPRX4HTTCYP2D6CYP2C9 | |
| SCHEMBL2422376 | 0.86 | ALDH1A1 (0.46) | MAPK8ALDH1A1HDAC3HDAC4HDAC1 | |
| SCHEMBL29136038 | 0.86 | YTHDC1 (0.45) | KMT2AMAPK8ALDH1A1PLGPLAU | |
| SCHEMBL29778946 | 0.86 | YTHDC1 (0.45) | KMT2AMAPK8ALDH1A1PLGPLAU | |
| SCHEMBL2120980 | 0.85 | MAPK14 (0.48) | KMT2ACYP2D6CYP2C9IDO1ALDH1A1 | |
| SCHEMBL2419097 | 0.83 | KMT2A (0.45) | KMT2AMRGPRX4HTTCYP2D6CYP2C9 | |
| SCHEMBL29136034 | 0.83 | EGLN1 (0.50) | KMT2AHTTCYP2D6CYP2C9HIF1A | |
| SCHEMBL29779010 | 0.81 | PLAU (0.47) | KMT2APLGPLAUHDAC3HDAC4 | |
| SCHEMBL29136066 | 0.81 | PLAU (0.47) | KMT2APLGPLAUHDAC3HDAC4 | |
| SCHEMBL29136018 | 0.79 | IDO1 (0.51) | MRGPRX4IDO1 |
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-117136186-A | Selective inhibitors of ROCK1 and ROCK2 protein kinases and uses thereof | 盖诺斯克公司 | 2023-11-28 | — | — | CN | disclosed |