Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.37 |
| ▸ | MAPT | P10636 | 5/20 | 0.37 |
| ▸ | GAA | P10253 | 4/20 | 0.37 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.37 |
| ▸ | MEN1 | O00255 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | GLA | P06280 | 2/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5740682 | 0.99 | PTGS2 (0.38) | PTGS2ALDH1A1MAPTGAAHPGD | |
| SCHEMBL5741841 | 0.81 | FABP4 (0.33) | MAPK1HTT | |
| SCHEMBL6689643 | 0.80 | ABCC1 (0.41) | ALDH1A1MAPTGAAHPGDLMNA | |
| SCHEMBL5740679 | 0.78 | ALDH1A1 (0.40) | ALDH1A1MAPTGAAHPGDLMNA | |
| SCHEMBL5739667 | 0.78 | MAPT (0.41) | ALDH1A1MAPTGAAHPGDLMNA | |
| SCHEMBL5741304 | 0.73 | HSD17B10 (0.44) | ALDH1A1MAPTGAALMNAKMT2A | |
| SCHEMBL10600228 | 0.73 | MAPT (0.54) | ALDH1A1MAPTGAAHPGDLMNA | |
| SCHEMBL31217547 | 0.71 | ALDH1A1 (0.55) | ALDH1A1MAPTGAAHPGDLMNA | |
| SCHEMBL29292345 | 0.70 | ALDH1A1 (0.44) | ALDH1A1MAPTGAAHPGDLMNA | |
| SCHEMBL5738977 | 0.70 | ALDH1A1 (0.38) | ALDH1A1MAPTGAAHPGDKMT2A |
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-1406891-A1 | THIOCHROMENONES USED TO COMBAT PAINFUL CONDITIONS AND NEURODEGENERATIVE DISEASES | Bayer HealthCare AG (DE) | 2004-04-14 | — | — | EP | disclosed |
| WO-2003053955-A1 | THIOCHROMENONES USED TO COMBAT PAINFUL CONDITIONS AND NEURODEGENERATIVE DISEASES | BAYER HEALTHCARE AG (DE) | 2003-07-03 | — | — | WO | disclosed |