Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | SIRT5 | Q9NXA8 | 16/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL19675751 | 0.83 | KDM6B (0.44) | ALDH1A1SIRT5KDM4EHPGDHSD17B10 | |
| SCHEMBL15584495 | 0.83 | HSP90AA1 (0.61) | ALDH1A1KDM4ECYP1A2CYP3A4CYP2C9 | |
| SCHEMBL22866255 | 0.83 | ALDH1A1 (0.55) | ALDH1A1SIRT5KDM4ECYP1A2CYP3A4 | |
| SCHEMBL2019145 | 0.81 | ALDH1A1 (0.80) | ALDH1A1KDM4ECYP1A2CYP3A4CYP2C9 | |
| SCHEMBL15584083 | 0.81 | MKNK1 (0.60) | ALDH1A1SIRT5KDM4ERAB9ANPSR1 | |
| SCHEMBL19453365 | 0.80 | RAB9A (0.65) | ALDH1A1KDM4ERAB9ANPSR1NPC1 | |
| SCHEMBL15584093 | 0.80 | SIRT5 (0.57) | SIRT5NPC1MAPT | |
| SCHEMBL15585733 | 0.80 | SIRT5 (0.47) | ALDH1A1SIRT5RAB9ANPSR1 | |
| SCHEMBL15584594 | 0.80 | SIRT5 (0.51) | ALDH1A1SIRT5KDM4ERAB9ANPSR1 | |
| SCHEMBL11092599 | 0.79 | RAB9A (0.50) | ALDH1A1KDM4ERAB9ANPSR1NPC1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2840080-B1 | NITROGEN-CONTAINING HETEROCYCLIC COMPOUND OR SALT THEREOF | FUJIFILM CORP (JP) | 2017-12-06 | — | — | EP | disclosed |