Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.46 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CA4 | P22748 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.41 |
| ▸ | MMP2 | P08253 | 1/20 | 0.40 |
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.40 |
| ▸ | S1PR1 | P21453 | 3/20 | 0.40 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.40 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | LTA4H | P09960 | 2/20 | 0.39 |
| ▸ | SNCA | P37840 | 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 | |
|---|---|---|---|---|
| SCHEMBL11402398 | 0.88 | S1PR1 (0.48) | S1PR1S1PR3S1PR2ALDH1A1MEN1 | |
| SCHEMBL5352838 | 0.79 | LOXL2 (0.53) | SAE1UBA2CA12CA1CA2 | |
| SCHEMBL3669498 | 0.78 | ALDH1A1 (0.56) | HTTFFAR1S1PR1S1PR3S1PR2 | |
| SCHEMBL6593426 | 0.76 | EPHX2 (0.67) | CA1CA2MEN1KMT2AEPHX2 | |
| Glycine SCHEMBL8212893 | 0.76 | EGFR (0.46) | SAE1UBA2CA1CA2LOXL2 | |
| SCHEMBL29912750 | 0.75 | LOXL2 (0.65) | SAE1UBA2CA12CA1CA2 | |
| SCHEMBL534926 | 0.74 | FFAR1 (0.53) | FFAR1SCN8A | |
| SCHEMBL28162772 | 0.74 | CTBP2 (0.49) | SAE1UBA2CA1CA2LOXL2 | |
| Water SCHEMBL29120229 | 0.73 | EGFR (0.52) | CA12CA2CA9ALDH1A1MEN1 | |
| SCHEMBL7047 | 0.73 | EGFR (0.52) | CA12CA2CA9ALDH1A1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1994020457-A1 | N-ACYL BETA AMINO ACID DERIVATIVES USEFUL AS PLATELET AGGREGATION INHIBITORS | G.D. SEARLE & CO. (US) | 1994-09-15 | — | — | WO | disclosed |