Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | F12 | P00748 | 3/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL20179555 | 0.75 | HPGD (0.62) | GAANPSR1ALDH1A1TSHRMEN1 | |
| SCHEMBL20179556 | 0.71 | CTSK (0.48) | GAANPSR1CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL20179646 | 0.71 | GAA (0.43) | GAANPSR1ALDH1A1TSHRMEN1 | |
| SCHEMBL20179732 | 0.69 | USP2 (0.45) | USP2GAANPSR1ALDH1A1TSHR | |
| SCHEMBL1107021 | 0.67 | GAA (0.62) | USP2GAANPSR1ALDH1A1TSHR | |
| SCHEMBL28820376 | 0.66 | USP2 (0.67) | USP2CYP3A4CYP2D6CYP2C19ALDH1A1 | |
| SCHEMBL24799334 | 0.66 | USP2 (0.44) | USP2GAANPSR1ALDH1A1TSHR | |
| SCHEMBL10253878 | 0.66 | GAA (0.60) | USP2GAANPSR1ALDH1A1TSHR | |
| SCHEMBL17397492 | 0.66 | POLB (0.41) | USP2GAANPSR1ALDH1A1TSHR | |
| SCHEMBL5298689 | 0.65 | KMT2A (0.59) | GAAALDH1A1TSHRMEN1KMT2A |
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-2018093695-A1 | FACTOR XIIa INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2018-05-24 | — | — | WO | disclosed |