Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | CACNA1H | O95180 | 4/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 4/20 | 0.41 |
| ▸ | DPP4 | P27487 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 4/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3617709 | 1.00 | ALDH1A1 (0.45) | ALDH1A1LMNACACNA1HMEN1POLB | |
| SCHEMBL3620629 | 1.00 | ALDH1A1 (0.45) | ALDH1A1LMNACACNA1HMEN1POLB | |
| SCHEMBL3622016 | 0.80 | EPHX2 (0.58) | ALDH1A1CACNA1HEPHX1KDM4EEPHX2 | |
| SCHEMBL3617705 | 0.80 | HSD11B1 (0.58) | ALDH1A1LMNAMEN1POLBMAPT | |
| SCHEMBL3620625 | 0.80 | HSD11B1 (0.58) | ALDH1A1LMNAMEN1POLBMAPT | |
| SCHEMBL3620658 | 0.78 | EPHX1 (0.55) | ALDH1A1CACNA1HEPHX1KDM4EEPHX2 | |
| SCHEMBL4106627 | 0.78 | EPHX2 (0.57) | ALDH1A1LMNAMEN1POLBKMT2A | |
| SCHEMBL3625180 | 0.73 | ALDH1A1 (0.51) | ALDH1A1CACNA1HEPHX1DPP4KDM4E | |
| SCHEMBL16395729 | 0.73 | EPHX2 (0.50) | ALDH1A1LMNACACNA1HMEN1MAPT | |
| SCHEMBL11890311 | 0.73 | ALDH1A1 (0.65) | ALDH1A1LMNAMEN1POLBMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-1935420-A1 | 2-Adamantyl-butyramide derivatives as selective 11beta-HSD1 inhibitors | Merck Sante (FR) | 2008-06-25 | — | — | EP | disclosed |