Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.51 |
| ▸ | MAPT | P10636 | 7/20 | 0.51 |
| ▸ | HTT | P42858 | 6/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | USP2 | O75604 | 1/20 | 0.51 |
| ▸ | ALPG | P10696 | 1/20 | 0.51 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 2/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 4/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8045879 | 0.92 | ALDH1A1 (0.60) | ALDH1A1MAPTHTTSMN1; SMN2LMNA | |
| SCHEMBL8042108 | 0.89 | PDK1 (0.50) | ALDH1A1MAPTHTTSMN1; SMN2LMNA | |
| SCHEMBL8042611 | 0.86 | PDK1 (0.53) | ALDH1A1MAPTHTTSMN1; SMN2LMNA | |
| SCHEMBL8044915 | 0.85 | RECQL (0.54) | ALDH1A1MAPTHTTSMN1; SMN2LMNA | |
| SCHEMBL8033645 | 0.84 | PDK1 (0.51) | ALDH1A1MAPTHTTSMN1; SMN2LMNA | |
| SCHEMBL8050410 | 0.84 | ALDH1A1 (0.46) | ALDH1A1MAPTHTTSMN1; SMN2LMNA | |
| SCHEMBL8032508 | 0.84 | MAPT (0.52) | ALDH1A1MAPTHTTSMN1; SMN2LMNA | |
| SCHEMBL8044622 | 0.83 | CA2 (0.53) | ALDH1A1MAPTHTTSMN1; SMN2LMNA | |
| SCHEMBL8049105 | 0.83 | PDK1 (0.50) | ALDH1A1MAPTHTTSMN1; SMN2LMNA | |
| SCHEMBL8049955 | 0.83 | PDK1 (0.50) | ALDH1A1MAPTHTTSMN1; SMN2LMNA |
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-6080772-A | 2-AMINOTHIAZOLE TRIAZOLE OR TETRAZOLE COMPOUND FOR REGULATING PROTEIN TYROSINE PHOSPHATASE ACTIVITY | SUGEN, INC. (US) | 2000-06-27 | — | — | US | disclosed |