Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLK1 | P53350 | 1/20 | 0.47 |
| ▸ | PLK3 | Q9H4B4 | 1/20 | 0.47 |
| ▸ | HCAR3 | P49019 | 2/20 | 0.44 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | THRA | P10827 | 3/20 | 0.42 |
| ▸ | THRB | P10828 | 3/20 | 0.42 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.41 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.41 |
| ▸ | RARB | P10826 | 4/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | RARA | P10276 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | MTOR | P42345 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8093812 | 1.00 | PLK1 (0.47) | PLK1PLK3HCAR3ESR1ALDH1A1 | |
| SCHEMBL8085598 | 1.00 | PLK1 (0.47) | PLK1PLK3HCAR3ESR1ALDH1A1 | |
| SCHEMBL8094383 | 0.99 | PLK1 (0.46) | PLK1PLK3HCAR3ESR1ALDH1A1 | |
| SCHEMBL8086387 | 0.94 | ALDH1A1 (0.44) | PLK1PLK3HCAR3ALDH1A1TDP1 | |
| SCHEMBL8093764 | 0.89 | HCAR3 (0.43) | HCAR3ALDH1A1MEN1KMT2APOLB | |
| SCHEMBL8086305 | 0.86 | HCAR3 (0.44) | PLK1PLK3HCAR3ESR1ALDH1A1 | |
| SCHEMBL8086985 | 0.86 | HCAR3 (0.44) | PLK1PLK3HCAR3ESR1ALDH1A1 | |
| SCHEMBL8095881 | 0.86 | HCAR3 (0.44) | PLK1PLK3HCAR3ESR1ALDH1A1 | |
| SCHEMBL8095194 | 0.85 | HCAR3 (0.45) | PLK1PLK3HCAR3ESR1ALDH1A1 | |
| SCHEMBL8096019 | 0.84 | PDK1 (0.50) | HCAR3ALDH1A1MEN1MAPTKMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0708077-B1 | Diamino compounds and methods for preparing them | CHISSO CORP (JP) | 2000-12-27 | — | — | EP | disclosed |
| US-5663440-A | Diamino compounds and methods for preparing them | CHISSO CORPORATION (JP) | 1997-09-02 | — | — | US | disclosed |
| EP-0708077-A1 | Diamino compounds and methods for preparing them | CHISSO CORPORATION (JP) | 1996-04-24 | — | — | EP | disclosed |