Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.49 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.49 |
| ▸ | FBP1 | P09467 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.45 |
| ▸ | MAPT | P10636 | 5/20 | 0.45 |
| ▸ | LMNA | P02545 | 5/20 | 0.45 |
| ▸ | TSHR | P16473 | 5/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | USP2 | O75604 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 6/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8045191 | 0.93 | FBP1 (0.48) | HSP90AA1HSP90AB1FBP1ALDH1A1SMN1; SMN2 | |
| SCHEMBL8041981 | 0.87 | FBP1 (0.50) | FBP1ALDH1A1SMN1; SMN2MAPTLMNA | |
| SCHEMBL8048727 | 0.83 | CYP1A2 (0.43) | FBP1ALDH1A1SMN1; SMN2MAPTLMNA | |
| SCHEMBL8042634 | 0.83 | HSP90AA1 (0.52) | HSP90AA1HSP90AB1ALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL8052342 | 0.82 | HCAR3 (0.43) | HSP90AA1HSP90AB1ALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL8043141 | 0.82 | SMN1; SMN2 (0.42) | HSP90AA1HSP90AB1ALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL8049876 | 0.81 | PDK1 (0.52) | ALDH1A1SMN1; SMN2MAPTLMNATSHR | |
| SCHEMBL8042675 | 0.80 | ALDH1A1 (0.51) | FBP1ALDH1A1SMN1; SMN2MAPTLMNA | |
| SCHEMBL8052354 | 0.80 | L3MBTL1 (0.46) | FBP1ALDH1A1MAPTLMNATSHR | |
| SCHEMBL8043551 | 0.78 | SMN1; SMN2 (0.51) | FBP1ALDH1A1SMN1; SMN2MAPTTSHR |
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 |