Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 5/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | GPR88 | Q9GZN0 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5052926 | 0.76 | HPGD (0.43) | HPGDCYP3A4CYP2D6CYP2C9PKM | |
| SCHEMBL5051273 | 0.73 | HPGD (0.45) | HPGDCYP3A4CYP2D6CYP2C9PKM | |
| SCHEMBL5060117 | 0.70 | HPGD (0.42) | HPGDCYP3A4CYP2D6CYP2C9PKM | |
| SCHEMBL5054537 | 0.68 | HPGD (0.48) | HPGDCYP3A4CYP2D6CYP2C9PKM | |
| SCHEMBL5054653 | 0.67 | HPGD (0.47) | HPGDCYP3A4CYP2D6CYP2C9PKM | |
| SCHEMBL5051305 | 0.67 | HPGD (0.50) | HPGDCYP3A4CYP2D6CYP2C9PKM | |
| SCHEMBL6037805 | 0.64 | HPGD (0.44) | HPGDCYP3A4CYP2D6CYP2C9PKM | |
| SCHEMBL5060114 | 0.62 | SLC6A3 (0.41) | HPGDCYP3A4CYP2D6CYP2C9PKM | |
| SCHEMBL18595547 | 0.62 | ANPEP (0.45) | HPGDALDH1A1SMN1; SMN2ALOX12 | |
| SCHEMBL891328 | 0.62 | HPGD (0.59) | HPGDCYP3A4CYP2D6CYP2C9PKM |
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 |
|---|---|---|---|---|---|---|---|
| WO-2006093991-A1 | COMPOUNDS WHICH BIND PSMA AND USES THEREOF | THE CLEVELAND CLINIC FOUNDATION (US) | 2006-09-08 | — | — | WO | disclosed |