Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | CETP | P11597 | 1/20 | 0.51 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.50 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.49 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.46 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.45 |
| ▸ | CES2 | O00748 | 1/20 | 0.44 |
| ▸ | CES1 | P23141 | 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 | |
|---|---|---|---|---|
| SCHEMBL9524030 | 0.98 | CETP (0.54) | HPGDALDH1A1CETPSIGMAR1HDAC3 | |
| SCHEMBL9131936 | 0.94 | ALDH1A1 (0.53) | HPGDALDH1A1CETPSIGMAR1HDAC3 | |
| SCHEMBL8526583 | 0.91 | KCNH2 (0.57) | ALDH1A1CETPSIGMAR1EPHX2KCNH2 | |
| SCHEMBL9427256 | 0.86 | ALDH1A1 (0.57) | HPGDALDH1A1CETPHDAC3KMT2A | |
| SCHEMBL7441543 | 0.85 | ALDH1A1 (0.67) | HPGDALDH1A1HDAC3KMT2AKEAP1 | |
| SCHEMBL1202480 | 0.81 | HPGD (0.54) | HPGDALDH1A1CETPSIGMAR1HDAC3 | |
| SCHEMBL9416074 | 0.81 | MEN1 (0.58) | ALDH1A1CETPEPHX2MEN1KMT2A | |
| Benzylacetone SCHEMBL9098200 | 0.80 | ALDH1A1 (0.72) | HPGDALDH1A1CETPHDAC3EPHX2 | |
| SCHEMBL9131203 | 0.80 | TDP1 (0.68) | — | |
| SCHEMBL4222999 | 0.79 | ALDH1A1 (0.59) | HPGDALDH1A1HDAC3KMT2AKEAP1 |
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-5430155-A | Viricides, treatment of AIDS | THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) | 1995-07-04 | — | — | US | disclosed |
| US-5294720-A | Viricides | THE DUPONT MERCK PHARMACEUTICAL CO. (US) | 1994-03-15 | — | — | US | disclosed |