Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | CCR8 | P51685 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.31 |
| ▸ | RHEB | Q15382 | 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 | |
|---|---|---|---|---|
| SCHEMBL12338439 | 0.72 | ALDH1A1 (0.65) | ALDH1A1CCR8KMT2AHSD17B10ADORA2A | |
| SCHEMBL12338438 | 0.70 | ALDH1A1 (0.63) | ALDH1A1CCR8KMT2AHSD17B10ADORA2A | |
| SCHEMBL10031 | 0.68 | ALDH1A1 (0.55) | ALDH1A1CCR8KMT2AHSD17B10KDM4E | |
| Iodide SCHEMBL7508631 | 0.67 | ALDH1A1 (0.53) | ALDH1A1CCR8KMT2AHSD17B10KDM4E | |
| SCHEMBL20677769 | 0.67 | ALDH1A1 (0.53) | ALDH1A1CCR8KMT2AHSD17B10KDM4E | |
| SCHEMBL15133539 | 0.67 | ALDH1A1 (0.59) | ALDH1A1CCR8KMT2AHSD17B10ADORA2A | |
| SCHEMBL6366012 | 0.67 | ALDH1A1 (0.53) | ALDH1A1CCR8KMT2AHSD17B10KDM4E | |
| SCHEMBL11166842 | 0.67 | ALDH1A1 (0.59) | ALDH1A1CCR8KMT2AHSD17B10ADORA2A | |
| Fluoride SCHEMBL4741374 | 0.67 | ALDH1A1 (0.53) | ALDH1A1CCR8KMT2AHSD17B10KDM4E | |
| Hydrochloric Acid SCHEMBL3397919 | 0.67 | ALDH1A1 (0.53) | ALDH1A1CCR8KMT2AHSD17B10KDM4E |
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-0223420-B1 | CONDENSED IMIDAZOPYRIDINE DERIVATIVES | SHIONOGI & CO., LTD. (JP) | 1991-02-27 | — | — | EP | disclosed |
| US-4753951-A | ANTIDEPRESSANTS, ANXIOLYTICS | SHIONOGI & CO., LTD. (JP) | 1988-06-28 | — | — | US | disclosed |
| EP-0223420-A1 | Condensed imidazopyridine derivatives | SHIONOGI & CO., LTD. (JP) | 1987-05-27 | — | — | EP | disclosed |