Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBXAS1 | P24557 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | LTA4H | P09960 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | NAMPT | P43490 | 1/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.39 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.38 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.38 |
| ▸ | TOP2A | P11388 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11729890 | 0.88 | ALDH1A1 (0.45) | ALDH1A1 | |
| Water SCHEMBL11728791 | 0.87 | ALDH1A1 (0.44) | ALDH1A1HDAC6 | |
| SCHEMBL11730754 | 0.87 | LTA4H (0.45) | ALDH1A1LTA4HNAMPT | |
| SCHEMBL11728417 | 0.85 | ALDH1A1 (0.42) | TBXAS1ALDH1A1NAMPT | |
| SCHEMBL11728838 | 0.82 | ALDH1A1 (0.42) | ALDH1A1LTA4HNAMPTTOP2A | |
| SCHEMBL11725475 | 0.82 | MAPK1 (0.46) | ALDH1A1LTA4HMAPK1TDP1 | |
| SCHEMBL11728716 | 0.81 | ALDH1A1 (0.40) | ALDH1A1KMT2ANAMPT | |
| SCHEMBL11726347 | 0.81 | CYP1A2 (0.41) | ALDH1A1HPGDNAMPTMAPK1TDP1 | |
| SCHEMBL11852592 | 0.80 | ALDH1A1 (0.42) | TBXAS1ALDH1A1LTA4HKMT2A | |
| SCHEMBL11728727 | 0.80 | ALDH1A1 (0.48) | TBXAS1ALDH1A1LTA4HKMT2AALOX5 |
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-4055596-A | PHARMACEUTICALS | MERCK & CO., INC. (US) | 1977-10-25 | — | — | US | disclosed |
| US-3991106-A | FOR ESTRUS SYNCHRONIZATION AND TREATMENT OF INFERTILITY | MERCK & CO., INC. (US) | 1976-11-09 | — | — | US | disclosed |