Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.55 |
| ▸ | HPGD | P15428 | 3/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 3/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | CNR2 | P34972 | 4/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.48 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL28940962 | 0.86 | ALDH1A1 (0.55) | ALDH1A1HPGDKDM4EHSD17B10POLB | |
| SCHEMBL27766592 | 0.86 | ALDH1A1 (0.55) | ALDH1A1HPGDKDM4EHSD17B10POLB | |
| SCHEMBL243892 | 0.78 | ALDH1A1 (0.71) | ALDH1A1HPGDKDM4EHSD17B10POLB | |
| SCHEMBL24921472 | 0.77 | KDM4E (0.61) | ALDH1A1HPGDKDM4EHSD17B10LMNA | |
| SCHEMBL28009793 | 0.74 | ALDH1A1 (0.66) | ALDH1A1HPGDKDM4EHSD17B10POLB | |
| SCHEMBL63778 | 0.73 | ALDH1A1 (0.73) | ALDH1A1HPGDKDM4EHSD17B10POLB | |
| SCHEMBL7707463 | 0.72 | RAB9A (0.51) | ALDH1A1HPGDKDM4EHSD17B10POLB | |
| SCHEMBL209882 | 0.72 | ALDH1A1 (0.71) | ALDH1A1HPGDKDM4EHSD17B10POLB | |
| Hydrochloric Acid SCHEMBL19119306 | 0.72 | ALDH1A1 (0.71) | ALDH1A1HPGDKDM4EHSD17B10POLB | |
| SCHEMBL19160257 | 0.72 | ALDH1A1 (0.71) | ALDH1A1HPGDKDM4EHSD17B10POLB |
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-1809653-B1 | SUBSTITUTED NONADEPSIPEPTIDES | AICURIS GMBH & CO KG (DE) | 2010-01-20 | — | — | EP | disclosed |
| EP-1809653-A1 | SUBSTITUTED NONADEPSIPEPTIDES | AiCuris GmbH & Co. KG (DE) | 2007-07-25 | — | — | EP | disclosed |
| WO-2006042654-A1 | SUBSTITUTED NONADEPSIPEPTIDES | AICURIS GMBH & CO. KG (DE) | 2006-04-27 | — | — | WO | disclosed |