Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | EGLN3 | Q9H6Z9 | 1/20 | 0.31 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | THRB | P10828 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL23876019 | 0.86 | HSP90AA1 (0.33) | HSP90AA1NPSR1EGLN3CYP19A1ALDH1A1 | |
| SCHEMBL23609146 | 0.82 | HSP90AA1 (0.33) | HSP90AA1NPSR1KMT2ACYP3A4CYP2C9 | |
| SCHEMBL23876037 | 0.82 | HSP90AA1 (0.31) | HSP90AA1NPSR1CYP3A4THRB | |
| SCHEMBL23876086 | 0.80 | EGLN3 (0.33) | HSP90AA1NPSR1EGLN3CYP19A1ALDH1A1 | |
| SCHEMBL23609212 | 0.80 | HSP90AA1 (0.37) | HSP90AA1NPSR1EGLN3CYP19A1ALDH1A1 | |
| SCHEMBL23608952 | 0.72 | PDE5A (0.36) | HSP90AA1NPSR1ALDH1A1CYP3A4CYP2C9 | |
| SCHEMBL23608955 | 0.70 | IRAK4 (0.33) | ALDH1A1KMT2ACYP3A4CYP2C9CYP1A2 | |
| SCHEMBL6632043 | 0.67 | HSP90AA1 (0.39) | HSP90AA1NPSR1EGLN3CYP19A1ALDH1A1 | |
| SCHEMBL10361215 | 0.62 | HSP90AA1 (0.32) | HSP90AA1NPSR1CYP3A4CYP2C9CYP1A2 | |
| SCHEMBL16471270 | 0.61 | GAA (0.53) | HSP90AA1NPSR1CYP19A1ALDH1A1KMT2A |
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-2021133689-A2 | LIPOXYGENASE INHIBITORS | SRI INTERNATIONAL (US) | 2021-07-01 | — | — | WO | disclosed |