Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.44 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 4/20 | 0.43 |
| ▸ | CA2 | P00918 | 4/20 | 0.43 |
| ▸ | CA9 | Q16790 | 3/20 | 0.43 |
| ▸ | CA12 | O43570 | 2/20 | 0.43 |
| ▸ | IDO1 | P14902 | 1/20 | 0.43 |
| ▸ | LTA4H | P09960 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | SLC15A1 | P46059 | 2/20 | 0.40 |
| ▸ | LAP3 | P28838 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL31479931 | 0.90 | DPP8 (0.41) | ALDH1A1SLC1A1SLC1A3CA1CA2 | |
| SCHEMBL27395771 | 0.82 | LMNA (0.50) | ALDH1A1SLC1A1SLC1A3CA1CA2 | |
| SCHEMBL7064408 | 0.82 | ALDH1A1 (0.44) | ALDH1A1CA1CA2CA9CA12 | |
| SCHEMBL7268383 | 0.81 | ALDH1A1 (0.62) | ALDH1A1SLC1A1SLC1A3IDO1LTA4H | |
| SCHEMBL10678429 | 0.81 | SLC1A1 (0.54) | ALDH1A1SLC1A1SLC1A3IDO1LTA4H | |
| SCHEMBL27464981 | 0.80 | CCR6 (0.40) | ALDH1A1CA1CA2CA9CA12 | |
| SCHEMBL30844639 | 0.80 | SLC1A1 (0.49) | ALDH1A1SLC1A1SLC1A3IDO1LTA4H | |
| Hydrochloric Acid SCHEMBL7268375 | 0.80 | ALDH1A1 (0.60) | ALDH1A1SLC1A1SLC1A3IDO1LTA4H | |
| SCHEMBL7715747 | 0.80 | CA1 (0.51) | ALDH1A1SLC1A1SLC1A3CA1CA2 | |
| SCHEMBL14196105 | 0.80 | SLC1A1 (0.48) | ALDH1A1SLC1A1SLC1A3IDO1LTA4H |
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 |
|---|---|---|---|---|---|---|---|
| CN-104017008-A | Boron-containing small molecules | ANACOR PHARMACEUTICALS INC | 2014-09-03 | — | — | CN | disclosed |