Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.45 |
| ▸ | PGR | P06401 | 2/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.39 |
| ▸ | AR | P10275 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 8/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 6/20 | 0.33 |
| ▸ | HTT | P42858 | 5/20 | 0.33 |
| ▸ | MITF | O75030 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | APP | P05067 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 2/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8538202 | 0.73 | CYP2A6 (0.32) | CYP2A6PGR | |
| SCHEMBL9777499 | 0.72 | CYP2A6 (0.56) | CYP2A6PGRALOX5ARMAPT | |
| SCHEMBL710696 | 0.70 | MAPT (0.37) | PGRMAPTKMT2AALDH1A1MEN1 | |
| SCHEMBL30390165 | 0.69 | ALDH1A1 (0.49) | MAPTKMT2AALDH1A1MEN1NPC1 | |
| SCHEMBL1956546 | 0.69 | ALDH1A1 (0.49) | MAPTKMT2AALDH1A1MEN1NPC1 | |
| SCHEMBL24573762 | 0.68 | HSD17B1 (0.42) | CYP2A6ARKMT2AALDH1A1MEN1 | |
| SCHEMBL264644 | 0.68 | XDH (0.51) | MAPTKMT2AMEN1HTTNPC1 | |
| SCHEMBL6261093 | 0.67 | MAPT (0.52) | CYP2A6MAPTKMT2AALDH1A1PSMD14 | |
| SCHEMBL12713528 | 0.67 | RAB9A (0.60) | CYP2A6MAPTALDH1A1NPC1KDM4E | |
| SCHEMBL15331164 | 0.67 | CYP2A6 (0.41) | CYP2A6PGRALOX5ARMAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-1998027092-A1 | THIAZOLE COMPOUNDS AND METHODS OF MODULATING SIGNAL TRANSDUCTION | SUGEN, INC. (US) | 1998-06-25 | — | — | WO | disclosed |