Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | PTPRB | P23467 | 1/20 | 0.43 |
| ▸ | LTA4H | P09960 | 2/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.40 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | ANPEP | P15144 | 1/20 | 0.39 |
| ▸ | RNPEP | Q9H4A4 | 1/20 | 0.39 |
| ▸ | DNPEP | Q9ULA0 | 1/20 | 0.39 |
| ▸ | CIT | O14578 | 1/20 | 0.39 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.39 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL12028836 | 1.00 | ALDH1A1 (0.46) | ALDH1A1PTPRBLTA4HESR1ESR2 | |
| SCHEMBL6572867 | 0.85 | ALDH1A1 (0.46) | ALDH1A1PTPRBLTA4HESR1ESR2 | |
| SCHEMBL12154904 | 0.84 | SLC7A5 (0.57) | ALDH1A1PTGS2SLC7A5 | |
| SCHEMBL826531 | 0.84 | SLC7A5 (0.57) | ALDH1A1PTGS2SLC7A5 | |
| SCHEMBL27278675 | 0.84 | ALDH1A1 (0.45) | ALDH1A1PTPRBLTA4HESR1ESR2 | |
| SCHEMBL20865324 | 0.84 | CA12 (0.48) | ALDH1A1CA12CA1CA2CA9 | |
| SCHEMBL11563068 | 0.84 | ALDH1A1 (0.45) | ALDH1A1PTPRBLTA4HESR1ESR2 | |
| SCHEMBL7902861 | 0.83 | ALDH1A1 (0.49) | ALDH1A1PTPRBLTA4HESR1ESR2 | |
| SCHEMBL22427551 | 0.82 | L3MBTL1 (0.54) | ALDH1A1PTPRBLTA4HCA12CA1 | |
| SCHEMBL27278672 | 0.82 | L3MBTL1 (0.54) | ALDH1A1PTPRBLTA4HCA12CA1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8476411-B2 | Compositions containing, methods involving, and uses of non-natural amino acids and polypeptides | AMBRX, INC. (US) | 2013-07-02 | — | — | US | disclosed |