Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.31 |
| ▸ | RELA | Q04206 | 1/20 | 0.31 |
| ▸ | TLR4 | O00206 | 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 | |
|---|---|---|---|---|
| SCHEMBL11203639 | 0.81 | ALDH1A1 (0.46) | ALDH1A1HPGDGAAMAPTSOAT1 | |
| SCHEMBL1568471 | 0.74 | CYP19A1 (0.46) | ALDH1A1HPGDGAAMAPTSOAT1 | |
| SCHEMBL13284120 | 0.74 | NOS3 (0.33) | KMT2AMEN1 | |
| SCHEMBL10361297 | 0.74 | CYP2D6 (0.51) | ALDH1A1MAPTCYP2D6KDM4EHSD17B10 | |
| SCHEMBL5739433 | 0.74 | ALDH1A1 (0.50) | ALDH1A1HPGDGAAMAPTKDM4E | |
| SCHEMBL10954374 | 0.70 | CYP19A1 (0.43) | ALDH1A1HPGDGAAMAPTSOAT1 | |
| SCHEMBL5740043 | 0.70 | MAPT (0.35) | ALDH1A1HPGDMAPTSOAT1CYP2D6 | |
| SCHEMBL5739286 | 0.69 | CYP2D6 (0.35) | ALDH1A1HPGDMAPTSOAT1CYP2D6 | |
| SCHEMBL9637170 | 0.68 | ALDH1A1 (0.43) | ALDH1A1HPGDGAAMAPTSOAT1 | |
| SCHEMBL11198763 | 0.68 | ALDH1A1 (0.39) | ALDH1A1HPGDGAAMAPTSOAT1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1406891-B1 | THIOCHROMENONES USED TO COMBAT PAINFUL CONDITIONS AND NEURODEGENERATIVE DISEASES | BAYER HEALTHCARE AG (DE) | 2006-03-22 | — | — | EP | disclosed |
| 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 |