Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.39 |
| ▸ | MAPT | P10636 | 6/20 | 0.39 |
| ▸ | HTT | P42858 | 4/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | ALPG | P10696 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | MAPK8 | P45983 | 4/20 | 0.37 |
| ▸ | MAPK9 | P45984 | 4/20 | 0.37 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 4/20 | 0.36 |
| ▸ | RAB9A | P51151 | 4/20 | 0.36 |
| ▸ | TLR9 | Q9NR96 | 3/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.36 |
| ▸ | S1PR4 | O95977 | 2/20 | 0.36 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | AGTR1 | P30556 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8043929 | 0.90 | MAPK8 (0.47) | ALDH1A1MAPTHTTGAAPKM | |
| SCHEMBL8051983 | 0.84 | MAPT (0.39) | ALDH1A1MAPTHTTGAAPKM | |
| SCHEMBL8044381 | 0.83 | ALDH1A1 (0.36) | ALDH1A1MAPTHTTGAAPKM | |
| SCHEMBL8042606 | 0.81 | ALDH1A1 (0.37) | ALDH1A1MAPTHTTGAAPKM | |
| SCHEMBL8032847 | 0.80 | ALDH1A1 (0.36) | ALDH1A1MAPTHTTGAAPKM | |
| SCHEMBL8050406 | 0.80 | ALDH1A1 (0.33) | ALDH1A1MAPTHTTGAAPKM | |
| SCHEMBL8050814 | 0.80 | MAPK8 (0.44) | ALDH1A1MAPTHTTGAAPKM | |
| SCHEMBL8050613 | 0.80 | MAPT (0.46) | ALDH1A1MAPTHTTGAAPKM | |
| SCHEMBL8049792 | 0.78 | KMT2A (0.35) | ALDH1A1MAPTHTTGAAPKM | |
| SCHEMBL8047853 | 0.78 | KMT2A (0.40) | ALDH1A1MAPTHTTGAAPKM |
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 |