Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKB | Q96GD4 | 2/20 | 0.55 |
| ▸ | AURKA | O14965 | 1/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 4/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | THRB | P10828 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | RECQL | P46063 | 3/20 | 0.40 |
| ▸ | BLM | P54132 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | BRCA1 | P38398 | 2/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.40 |
| ▸ | APP | P05067 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29608931 | 0.88 | AURKB (0.64) | AURKBAURKACYP1A2NR4A1MEN1 | |
| SCHEMBL156055 | 0.88 | AURKB (0.64) | AURKBAURKACYP1A2NR4A1MEN1 | |
| SCHEMBL1366830 | 0.86 | AURKB (0.62) | AURKBAURKACYP1A2NR4A1MEN1 | |
| SCHEMBL155097 | 0.86 | AURKB (0.62) | AURKBAURKACYP1A2NR4A1MEN1 | |
| SCHEMBL8508836 | 0.86 | AURKB (0.62) | AURKBAURKACYP1A2NR4A1MEN1 | |
| Water SCHEMBL12275143 | 0.85 | AURKB (0.60) | AURKBAURKACYP1A2NR4A1MEN1 | |
| SCHEMBL1459623 | 0.79 | NR4A1 (0.57) | AURKBAURKACYP1A2NR4A1MEN1 | |
| SCHEMBL29435294 | 0.79 | NR4A1 (0.57) | AURKBAURKACYP1A2NR4A1MEN1 | |
| SCHEMBL30683823 | 0.79 | NR4A1 (0.57) | AURKBAURKACYP1A2NR4A1MEN1 | |
| Hydrochloric Acid SCHEMBL5733553 | 0.76 | AURKB (0.65) | AURKBAURKACYP1A2NR4A1MEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-55116759-A | — | — | None | — | — | JP | disclosed |
| JP-S55116759-A | DISAZO DYE SOLUTION COMPOSITION | NIPPON KAGAKU KOGYOSHO:KK | 1980-09-08 | — | — | JP | disclosed |