Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2B | P29275 | 4/20 | 0.62 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.62 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.57 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | CASP1 | P29466 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CA7 | P43166 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | APEX1 | P27695 | 1/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL4253445 | 0.87 | ADORA2B (0.59) | ADORA2BADORA2AMAPK1HSD17B10PKM | |
| SCHEMBL4263419 | 0.86 | PKM (0.65) | ADORA2BMAPK1HSD17B10PKMCASP1 | |
| SCHEMBL3005564 | 0.81 | PKM (0.75) | ADORA2BADORA2AMAPK1HSD17B10PKM | |
| SCHEMBL10113271 | 0.79 | HSD17B10 (0.74) | ADORA2BADORA2AMAPK1HSD17B10POLB | |
| SCHEMBL2999682 | 0.79 | ADORA2B (0.69) | ADORA2BADORA2AMAPK1HSD17B10CASP1 | |
| SCHEMBL2994443 | 0.76 | ADORA2B (0.75) | ADORA2BADORA2AMAPK1HSD17B10 | |
| SCHEMBL10113267 | 0.76 | HSD17B10 (0.72) | ADORA2BADORA2AMAPK1HSD17B10POLB | |
| SCHEMBL10113258 | 0.74 | TSHR (0.75) | ADORA2BADORA2AMAPK1HSD17B10POLB | |
| SCHEMBL10113282 | 0.73 | MAPK1 (0.76) | ADORA2BADORA2AMAPK1HSD17B10POLB | |
| SCHEMBL2999627 | 0.72 | MAPT (0.65) | HSD17B10CASP1POLBALDH1A1TSHR |
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-2009006580-A1 | OPTIONALLY CONDENSED DIHYDROPYRIDINE, DIHYDROPYRIMIDINE AND DIHYDROPYRANE DERIVATIVES ACTING AS LATE SODIUM CHANNEL BLOCKERS | CV THERAPEUTICS, INC. (US) | 2009-01-08 | — | — | WO | disclosed |