Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | CTSG | P08311 | 3/20 | 0.32 |
| ▸ | CMA1 | P23946 | 3/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | USP2 | O75604 | 4/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.31 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL27807878 | 0.67 | CYP3A4 (0.35) | PKMALDH1A1CTSGCMA1TSHR | |
| SCHEMBL27807891 | 0.67 | ALDH1A1 (0.38) | PKMALDH1A1MEN1KMT2ATSHR | |
| SCHEMBL27807883 | 0.67 | CYP2D6 (0.34) | PKMALDH1A1CTSGCMA1MCL1 | |
| SCHEMBL1349414 | 0.65 | CTSG (0.47) | PKMALDH1A1KMT2ACTSGCMA1 | |
| SCHEMBL27828349 | 0.63 | LMNA (0.47) | PKMALDH1A1MEN1KMT2ATSHR | |
| SCHEMBL1349030 | 0.61 | NR1H2 (0.41) | PKMALDH1A1KMT2AUSP2HSD17B10 | |
| SCHEMBL1347358 | 0.59 | MMP2 (0.44) | PKMALDH1A1MEN1KMT2ACTSG | |
| SCHEMBL27771620 | 0.59 | — | — | |
| SCHEMBL5449733 | 0.58 | PKM (0.54) | PKMALDH1A1MEN1KMT2ACTSG | |
| SCHEMBL27878415 | 0.57 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-102056902-B | Imidazolidine derivatives | HOFFMANN LA ROCHE | 2013-08-07 | — | — | CN | disclosed |
| CN-102056902-A | Imidazolidine derivatives | HOFFMANN LA ROCHE | 2011-05-11 | — | — | CN | disclosed |