Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBXAS1 | P24557 | 14/20 | 0.51 |
| ▸ | ERN1 | O75460 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | BLM | P54132 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | ERCC1 | P07992 | 1/20 | 0.45 |
| ▸ | ERCC4 | Q92889 | 1/20 | 0.45 |
| ▸ | IDH1 | O75874 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL10955455 | 0.88 | ERN1 (0.48) | TBXAS1ERN1ERCC1ERCC4 | |
| SCHEMBL6166029 | 0.88 | ERN1 (0.58) | TBXAS1ERN1 | |
| SCHEMBL1134433 | 0.82 | IDH1 (0.63) | IDH1 | |
| SCHEMBL21001943 | 0.82 | CA1 (0.54) | MEN1KMT2AIDH1 | |
| SCHEMBL10702687 | 0.81 | IDH1 (0.61) | TBXAS1MEN1TP53CYP3A4BLM | |
| SCHEMBL8131362 | 0.79 | POLB (0.58) | ERN1 | |
| SCHEMBL21001935 | 0.78 | IDH1 (0.49) | CYP3A4IDH1 | |
| SCHEMBL10957763 | 0.78 | TBXAS1 (0.44) | TBXAS1ERN1 | |
| SCHEMBL10331741 | 0.77 | CA1 (0.65) | BLMIDH1 | |
| SCHEMBL10331745 | 0.77 | ESR1 (0.54) | MEN1KMT2AIDH1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4495357-A | THROMBOXANE A2 SYNTHETASE INHIBITORS | THE UPJOHN COMPANY (US) | 1985-01-22 | — | — | US | disclosed |
| EP-0069521-A2 | Pyridinyl and imidazolyl derivatives of benzofurans and benzothiophenes | THE UPJOHN COMPANY (US) | 1983-01-12 | — | — | EP | disclosed |