Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1A1 | P14550 | 1/20 | 0.43 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.43 |
| ▸ | ALB | P02768 | 1/20 | 0.42 |
| ▸ | HSD17B1 | P14061 | 3/20 | 0.40 |
| ▸ | HSD17B2 | P37059 | 3/20 | 0.40 |
| ▸ | MAOB | P27338 | 2/20 | 0.38 |
| ▸ | NAAA | Q02083 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.36 |
| ▸ | RELA | Q04206 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.36 |
| ▸ | TTR | P02766 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19691127 | 0.85 | DYRK1A (0.43) | AKR1A1AKR1B1HSD17B1HSD17B2MAOB | |
| SCHEMBL6977213 | 0.85 | GAA (0.40) | AKR1A1AKR1B1HSD17B1HSD17B2NAAA | |
| SCHEMBL30587519 | 0.79 | AKR1B1 (0.42) | AKR1B1SMN1; SMN2ALDH1A1MAPTNPC1 | |
| SCHEMBL18366688 | 0.77 | RIPK1 (0.47) | SMN1; SMN2ALDH1A1MAPTNPC1RAB9A | |
| SCHEMBL30587482 | 0.77 | RIPK1 (0.47) | SMN1; SMN2ALDH1A1MAPTNPC1RAB9A | |
| SCHEMBL6972014 | 0.76 | PLOD2 (0.41) | AKR1A1AKR1B1HSD17B1HSD17B2MAOB | |
| SCHEMBL30626911 | 0.74 | RAB9A (0.42) | SMN1; SMN2ALDH1A1MAPTNPC1RAB9A | |
| SCHEMBL7216764 | 0.74 | RAB9A (0.42) | SMN1; SMN2ALDH1A1MAPTNPC1RAB9A | |
| Trifluoroacetic Acid SCHEMBL29974297 | 0.73 | SMN1; SMN2 (0.41) | AKR1A1AKR1B1NAAASMN1; SMN2ALDH1A1 | |
| SCHEMBL2116026 | 0.72 | SMN1; SMN2 (0.54) | AKR1A1AKR1B1SMN1; SMN2ALDH1A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010027875-A2 | COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM | CALCIMEDICA INC. (US) | 2010-03-11 | — | — | WO | disclosed |