Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.54 |
| ▸ | CES2 | O00748 | 1/20 | 0.53 |
| ▸ | CES1 | P23141 | 1/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | ATM | Q13315 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 3/20 | 0.49 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL735945 | 0.89 | ATM (0.59) | TP53ALDH1A1CES2CES1ATM | |
| SCHEMBL10530983 | 0.83 | ALDH1A1 (0.57) | TP53ALDH1A1CES2CES1MEN1 | |
| SCHEMBL9509458 | 0.83 | TP53 (0.65) | TP53ALDH1A1CES2CES1NPSR1 | |
| SCHEMBL6325991 | 0.82 | ALDH1A1 (0.60) | TP53ALDH1A1CES2CES1NPSR1 | |
| SCHEMBL7472248 | 0.82 | ALDH1A1 (0.56) | TP53ALDH1A1CES2CES1NPSR1 | |
| SCHEMBL1418030 | 0.79 | CES2 (0.54) | ALDH1A1CES2MEN1KMT2APOLB | |
| SCHEMBL7055735 | 0.79 | CES2 (0.54) | ALDH1A1CES2MEN1KMT2APOLB | |
| SCHEMBL28148999 | 0.79 | TP53 (0.59) | TP53ALDH1A1CES2CES1NPSR1 | |
| SCHEMBL698882 | 0.79 | ADRA2C (0.64) | ALDH1A1MEN1KMT2AGAATSHR | |
| SCHEMBL11503382 | 0.79 | ADRA2C (0.49) | ALDH1A1MEN1KMT2AGAATSHR |
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-0625523-B1 | process of preparing a cis-oxalato(trans-L-1,2-cyclohexanediamine) Pt(II) complex having high optical purity | DEBIOPHARM SA (CH) | 2001-10-31 | — | — | EP | claimed |