Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8482159 | 0.81 | HPRT1 (0.31) | — | |
| SCHEMBL7450361 | 0.80 | NT5E (0.31) | — | |
| SCHEMBL8483306 | 0.78 | — | — | |
| SCHEMBL7401015 | 0.78 | — | — | |
| SCHEMBL8479578 | 0.76 | CA1 (0.33) | — | |
| SCHEMBL8480379 | 0.73 | CYP1A2 (0.33) | ALDH1A1CYP3A4HPGDTSHRHSD17B10 | |
| SCHEMBL8483234 | 0.71 | ALDH1A1 (0.30) | ALDH1A1CYP3A4HPGDTSHRHSD17B10 | |
| SCHEMBL8481907 | 0.70 | CA2 (0.31) | ALDH1A1HPGDHSD17B10 | |
| SCHEMBL8478282 | 0.69 | KDM4E (0.31) | — | |
| SCHEMBL15063792 | 0.66 | TRPA1 (0.30) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5939418-A | ANTICOAGULANT | THE DUPONT MERCK PHARMACEUTICAL COMPANY (US) | 1999-08-17 | — | — | US | disclosed |