Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 4/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | APEX1 | P27695 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | F2 | P00734 | 1/20 | 0.34 |
| ▸ | F10 | P00742 | 1/20 | 0.34 |
| ▸ | F11 | P03951 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL26824 | 0.86 | ALDH1A1 (0.39) | ALDH1A1MAPTPOLBLMNAKMT2A | |
| SCHEMBL5148775 | 0.76 | ALDH1A1 (0.40) | ALDH1A1MAPTPOLBLMNAKMT2A | |
| SCHEMBL25845 | 0.74 | CYP2D6 (0.41) | ALDH1A1LMNAKMT2AMEN1GAA | |
| SCHEMBL25513 | 0.68 | CYP2D6 (0.43) | ALDH1A1LMNAKMT2AMEN1GAA | |
| SCHEMBL25883 | 0.68 | LMNA (0.41) | ALDH1A1POLBLMNAKMT2AMEN1 | |
| Acetic Acid SCHEMBL7116066 | 0.67 | ALDH1A1 (0.42) | ALDH1A1MAPTLMNAPKML3MBTL1 | |
| SCHEMBL30827513 | 0.64 | ALDH1A1 (0.78) | ALDH1A1MAPTLMNAKMT2ATDP1 | |
| SCHEMBL1628833 | 0.64 | ALDH1A1 (0.78) | ALDH1A1MAPTLMNAKMT2ATDP1 | |
| SCHEMBL5363086 | 0.64 | ALDH1A1 (0.63) | ALDH1A1MAPTLMNAKMT2ATDP1 | |
| Gabapentin SCHEMBL3169938 | 0.64 | ALDH1A1 (0.47) | ALDH1A1LMNAKMT2ABLML3MBTL1 |
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-2085087-A1 | Prodrugs of gaba analogs, compositions and uses thereof | Xenoport, Inc. (US) | 2009-08-05 | — | — | EP | disclosed |