Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACA | Q13085 | 3/20 | 0.71 |
| ▸ | AURKA | O14965 | 1/20 | 0.63 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.63 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.55 |
| ▸ | MAPT | P10636 | 4/20 | 0.55 |
| ▸ | HPGD | P15428 | 4/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | HTT | P42858 | 2/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.52 |
| ▸ | ACHE | P22303 | 1/20 | 0.52 |
| ▸ | PPARG | P37231 | 1/20 | 0.52 |
| ▸ | NR2E3 | Q9Y5X4 | 1/20 | 0.52 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | ENPP3 | O14638 | 1/20 | 0.51 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL13458687 | 1.00 | ACACA (0.71) | ACACAAURKAAURKBKDM4EALDH1A1 | |
| SCHEMBL13458889 | 0.98 | ACACA (0.73) | ACACAAURKAAURKBKDM4EALDH1A1 | |
| SCHEMBL3704468 | 0.98 | ACACA (0.73) | ACACAAURKAAURKBKDM4EALDH1A1 | |
| SCHEMBL3358750 | 0.87 | ACACA (0.50) | ACACAAURKAAURKBKDM4EALDH1A1 | |
| SCHEMBL3358457 | 0.87 | ACACA (0.50) | ACACAAURKAAURKBKDM4EALDH1A1 | |
| SCHEMBL3698074 | 0.87 | ACACA (0.50) | ACACAAURKAAURKBKDM4EALDH1A1 | |
| SCHEMBL17899330 | 0.87 | ACACA (0.50) | ACACAAURKAAURKBKDM4EALDH1A1 | |
| SCHEMBL1745982 | 0.87 | ACACA (0.50) | ACACAAURKAAURKBKDM4EALDH1A1 | |
| SCHEMBL13458750 | 0.86 | MCL1 (0.54) | ACACAAURKAAURKBHPGDSMN1; SMN2 | |
| SCHEMBL28201489 | 0.86 | ACACA (0.68) | ACACAAURKAAURKBKDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2161272-A1 | Phenanthrolines | BASF SE (DE) | 2010-03-10 | — | — | EP | disclosed |