Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPM4 | Q8TD43 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.55 |
| ▸ | HPGD | P15428 | 2/20 | 0.55 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.54 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.54 |
| ▸ | HPRT1 | P00492 | 3/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | LCK | P06239 | 1/20 | 0.45 |
| ▸ | FYN | P06241 | 1/20 | 0.45 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.45 |
| ▸ | ACHE | P22303 | 1/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.45 |
| ▸ | AHR | P35869 | 1/20 | 0.45 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.45 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.45 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL27512764 | 0.93 | ALDH1A1 (0.55) | TRPM4ALDH1A1CYP1A2HSD17B10HPGD | |
| SCHEMBL23912230 | 0.89 | ALDH1A1 (0.58) | TRPM4ALDH1A1CYP1A2HSD17B10HPGD | |
| SCHEMBL27994596 | 0.87 | HPRT1 (0.50) | TRPM4ALDH1A1CYP1A2HSD17B10HPGD | |
| SCHEMBL11726972 | 0.84 | TRPM4 (0.68) | TRPM4ALDH1A1CYP1A2HSD17B10HPGD | |
| SCHEMBL597667 | 0.80 | ALDH1A1 (0.68) | ALDH1A1CYP1A2HSD17B10HPGDCYP1B1 | |
| SCHEMBL888299 | 0.80 | ALDH1A1 (0.68) | TRPM4ALDH1A1CYP1A2HSD17B10HPGD | |
| SCHEMBL27760500 | 0.79 | TRPM4 (0.65) | TRPM4ALDH1A1CYP1A2HSD17B10HPGD | |
| SCHEMBL31171122 | 0.78 | ALDH1A1 (0.65) | TRPM4ALDH1A1CYP1A2HSD17B10HPGD | |
| SCHEMBL598522 | 0.78 | HPRT1 (0.64) | ALDH1A1CYP1A2HSD17B10HPGDCYP1B1 | |
| SCHEMBL31235727 | 0.78 | HPRT1 (0.64) | ALDH1A1CYP1A2HSD17B10HPGDCYP1B1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105367582-A | Bilobalide B derivative and application of bilobalide B derivative in medicine | GUANGDONG HEC PHARMACEUTICAL | 2016-03-02 | — | — | CN | disclosed |