Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | NAMPT | P43490 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11732372 | 0.93 | FAAH (0.36) | — | |
| SCHEMBL11726347 | 0.89 | CYP1A2 (0.41) | ALDH1A1NAMPTPPARG | |
| SCHEMBL11731240 | 0.88 | ALDH1A1 (0.43) | ALDH1A1KDM4EKMT2AL3MBTL1 | |
| SCHEMBL11726046 | 0.87 | FAAH (0.40) | — | |
| SCHEMBL11730754 | 0.87 | LTA4H (0.45) | ALDH1A1NAMPT | |
| SCHEMBL11726905 | 0.84 | NPC1 (0.40) | — | |
| SCHEMBL11852592 | 0.82 | ALDH1A1 (0.42) | ALDH1A1KMT2AL3MBTL1 | |
| SCHEMBL11848646 | 0.82 | MAPT (0.43) | ALDH1A1KMT2AL3MBTL1 | |
| SCHEMBL11730971 | 0.82 | ADRB2 (0.43) | KMT2A | |
| SCHEMBL11728722 | 0.81 | TBXAS1 (0.42) | ALDH1A1KMT2ANAMPT |
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 |