Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.57 |
| ▸ | TSHR | P16473 | 4/20 | 0.57 |
| ▸ | MAPT | P10636 | 3/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.57 |
| ▸ | RAB9A | P51151 | 10/20 | 0.51 |
| ▸ | NPC1 | O15118 | 8/20 | 0.51 |
| ▸ | CASP1 | P29466 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 8/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.49 |
| ▸ | HPGD | P15428 | 6/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | RELA | Q04206 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8128905 | 0.81 | KDM4E (0.45) | ALDH1A1TSHRMAPTHSD17B10RAB9A | |
| SCHEMBL8127706 | 0.77 | ALDH1A1 (0.52) | ALDH1A1TSHRMAPTHSD17B10RAB9A | |
| SCHEMBL7568801 | 0.75 | RAB9A (0.49) | ALDH1A1TSHRMAPTMAPK1HSD17B10 | |
| SCHEMBL234625 | 0.74 | TSHR (0.52) | ALDH1A1TSHRMAPK1HSD17B10SMN1; SMN2 | |
| SCHEMBL8120086 | 0.74 | ALDH1A1 (0.49) | ALDH1A1TSHRMAPTMAPK1HSD17B10 | |
| SCHEMBL1827277 | 0.73 | RAB9A (0.50) | ALDH1A1TSHRMAPTMAPK1HSD17B10 | |
| SCHEMBL29013549 | 0.73 | SLC6A3 (0.42) | MAPK1 | |
| SCHEMBL5656613 | 0.73 | SLC6A3 (0.45) | ALDH1A1MAPTSMN1; SMN2HPGDKDM4E | |
| SCHEMBL5656195 | 0.73 | ATR (0.39) | ALDH1A1KMT2AGAA | |
| SCHEMBL27553475 | 0.72 | RAB9A (0.52) | ALDH1A1TSHRMAPTMAPK1HSD17B10 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1210324-A1 | SUBSTITUTED CYCLOPENTENES, THEIR PREPARATION AND THEIR USE FOR CHIRAL SCAFFOLDS | Chirotech Technology Limited (GB) | 2002-06-05 | — | — | EP | disclosed |
| WO-2001017952-A1 | SUBSTITUTED CYCLOPENTENES, THEIR PREPARATION AND THEIR USE FOR CHIRAL SCAFFOLDS | CHIROTECH TECHNOLOGY LIMITED (GB) | 2001-03-15 | — | — | WO | disclosed |