Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8044718 | 0.93 | ALDH1A1 (0.31) | ALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL8043479 | 0.90 | — | — | |
| SCHEMBL8050184 | 0.84 | NPC1 (0.32) | NPC1RAB9ASMN1; SMN2NPSR1 | |
| SCHEMBL8032733 | 0.83 | KMT2A (0.33) | ALDH1A1RAB9ASMN1; SMN2NPSR1 | |
| SCHEMBL8042516 | 0.83 | — | — | |
| SCHEMBL8033664 | 0.80 | RAB9A (0.39) | ALDH1A1NPC1RAB9ASMN1; SMN2NPSR1 | |
| SCHEMBL8032506 | 0.79 | — | — | |
| SCHEMBL8033633 | 0.77 | ALDH1A1 (0.33) | ALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL8052246 | 0.75 | KMT2A (0.36) | ALDH1A1SMN1; SMN2NPSR1 | |
| SCHEMBL8046353 | 0.73 | TRPM8 (0.31) | — |
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 |