Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F2 | P00734 | 1/20 | 0.57 |
| ▸ | PLG | P00747 | 1/20 | 0.57 |
| ▸ | PLAU | P00749 | 1/20 | 0.57 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.57 |
| ▸ | KLK1 | P06870 | 1/20 | 0.57 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.57 |
| ▸ | CES2 | O00748 | 1/20 | 0.50 |
| ▸ | CES1 | P23141 | 1/20 | 0.50 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | EGFR | P00533 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL18936130 | 0.78 | CES2 (0.57) | F2PLGPLAUKLKB1KLK1 | |
| SCHEMBL5255384 | 0.76 | CES2 (0.50) | F2PLGPLAUKLKB1KLK1 | |
| SCHEMBL29521906 | 0.76 | CES2 (0.50) | F2PLGPLAUKLKB1KLK1 | |
| SCHEMBL29645049 | 0.76 | CES1 (0.61) | CES2CES1PTPN1KDM4EHPGD | |
| SCHEMBL3555820 | 0.76 | CES2 (0.50) | F2PLGPLAUKLKB1KLK1 | |
| SCHEMBL4307207 | 0.76 | CES1 (0.61) | CES2CES1PTPN1KDM4EHPGD | |
| SCHEMBL14276747 | 0.73 | CES1 (0.52) | F2PRSS1CES2CES1ALDH1A1 | |
| SCHEMBL14077354 | 0.73 | ESR1 (0.50) | F2PLGPLAUKLKB1KLK1 | |
| SCHEMBL10150845 | 0.73 | ALDH1A1 (0.47) | F2PLGPLAUKLKB1KLK1 | |
| Beta-Naphtoic Acid SCHEMBL30260090 | 0.73 | PTPN1 (0.57) | CES2CES1PTPN1KDM4EHPGD |
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 |
|---|---|---|---|---|---|---|---|
| CN-110437230-B | Tertiary amine compound, diphosphine ligand, intermediate and preparation method thereof | 中国科学院上海有机化学研究所 | 2022-06-21 | — | — | CN | disclosed |