Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPKAPK2 | P49137 | 9/20 | 0.43 |
| ▸ | CDK2 | P24941 | 8/20 | 0.43 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.43 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.43 |
| ▸ | GSK3B | P49841 | 1/20 | 0.43 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.43 |
| ▸ | MAPKAPK5 | Q8IW41 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.41 |
| ▸ | CDK1 | P06493 | 1/20 | 0.41 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.41 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.41 |
| ▸ | MAPKAPK3 | Q16644 | 1/20 | 0.41 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.38 |
| ▸ | AHR | P35869 | 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 | |
|---|---|---|---|---|
| SCHEMBL8573402 | 0.82 | KMT2A (0.43) | MAPKAPK2CDK2ROCK2MAPK9GSK3B | |
| SCHEMBL8573924 | 0.76 | CDK2 (0.42) | MAPKAPK2CDK2ROCK2MAPK9GSK3B | |
| SCHEMBL8572544 | 0.76 | KMT2A (0.46) | KMT2AMEN1ALDH1A1TRPA1HPGD | |
| SCHEMBL31453688 | 0.75 | KMT2A (0.59) | MAPKAPK2CDK2ROCK2MAPK9GSK3B | |
| SCHEMBL9008342 | 0.75 | KMT2A (0.59) | MAPKAPK2CDK2ROCK2MAPK9GSK3B | |
| SCHEMBL8574021 | 0.75 | TRPA1 (0.40) | MAPKAPK2CDK2ROCK2MAPK9GSK3B | |
| SCHEMBL8664359 | 0.73 | ALDH1A1 (0.40) | KCNH2KMT2AMEN1ALDH1A1TRPA1 | |
| SCHEMBL8574961 | 0.72 | MAPT (0.41) | KCNH2KMT2AMEN1ALDH1A1TRPA1 | |
| SCHEMBL8575750 | 0.71 | MAPT (0.41) | KCNH2KMT2AMEN1ALDH1A1TRPA1 | |
| SCHEMBL8574078 | 0.71 | MAPKAPK2 (0.42) | MAPKAPK2CDK2KMT2AMEN1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5821240-A | ENZYME INHIBITORS, SIGNAL INHIBITORS FOR ANTIINFLAMMATORY AGENTS, ANTICARCINOGENIC AGENTS, ANTITUMOR AGENTS AND HORMONE INHIBITORS | DR. KARL THOMAE GMBH (DE) | 1998-10-13 | — | — | US | disclosed |