Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.46 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.46 |
| ▸ | PDE9A | O76083 | 2/20 | 0.36 |
| ▸ | CA1 | P00915 | 3/20 | 0.35 |
| ▸ | CA2 | P00918 | 3/20 | 0.35 |
| ▸ | EGFR | P00533 | 1/20 | 0.35 |
| ▸ | SRC | P12931 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | STAT3 | P40763 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2546104 | 0.85 | ALDH1A1 (0.59) | ALDH1A1KDM4EMEN1KMT2AGAA | |
| SCHEMBL148856 | 0.80 | ALDH1A1 (0.59) | ALDH1A1KDM4EMEN1KMT2AGAA | |
| SCHEMBL150623 | 0.77 | ALDH1A1 (0.64) | ALDH1A1KDM4EMEN1KMT2AGAA | |
| SCHEMBL29429129 | 0.77 | ALDH1A1 (0.64) | ALDH1A1KDM4EMEN1KMT2AGAA | |
| SCHEMBL514645 | 0.74 | ALDH1A1 (0.48) | ALDH1A1KDM4EMEN1KMT2AGAA | |
| SCHEMBL5252145 | 0.73 | ALDH1A1 (0.46) | ALDH1A1KDM4EMEN1KMT2AGAA | |
| SCHEMBL5252143 | 0.73 | ALDH1A1 (0.46) | ALDH1A1KDM4EMEN1KMT2AGAA | |
| SCHEMBL7307452 | 0.70 | CA1 (0.46) | ALDH1A1KDM4EMEN1KMT2AGAA | |
| SCHEMBL16213053 | 0.69 | TSHR (0.57) | ALDH1A1KDM4EMEN1KMT2AGAA | |
| SCHEMBL4063685 | 0.69 | ALDH1A1 (0.52) | ALDH1A1KDM4EMEN1KMT2AGAA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5629406-A | AMINO ACID DERIVATIVES | SANKYO COMPANY, LIMITED (JP) | 1997-05-13 | — | — | US | disclosed |
| EP-0587311-A1 | Peptides capable of inhibiting the activity of HIV protease, their preparation and their therapeutic use | SANKYO COMPANY LIMITED (JP) | 1994-03-16 | — | — | EP | disclosed |