Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APLNR | P35414 | 1/20 | 0.54 |
| ▸ | HTR2A | P28223 | 1/20 | 0.47 |
| ▸ | HTR2C | P28335 | 1/20 | 0.47 |
| ▸ | DHFR | P00374 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.43 |
| ▸ | PRKACA | P17612 | 1/20 | 0.43 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.43 |
| ▸ | GSK3A | P49840 | 1/20 | 0.43 |
| ▸ | GSK3B | P49841 | 1/20 | 0.43 |
| ▸ | IRAK1 | P51617 | 1/20 | 0.43 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.43 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.43 |
| ▸ | CDC42BPA | Q5VT25 | 1/20 | 0.43 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.43 |
| ▸ | CSNK1G3 | Q9Y6M4 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 9/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 7/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4599467 | 0.84 | APLNR (0.54) | APLNRHTR2AHTR2CDHFRNPC1 | |
| SCHEMBL4599690 | 0.84 | APLNR (0.54) | APLNRHTR2AHTR2CDHFRNPC1 | |
| SCHEMBL4599375 | 0.81 | MAPT (0.55) | NPC1PKMRAB9ALMNAALDH1A1 | |
| SCHEMBL4599680 | 0.79 | MAPT (0.52) | APLNRDHFRNPC1PKMRAB9A | |
| SCHEMBL4600346 | 0.79 | APLNR (0.48) | APLNRDHFRNPC1PKMRAB9A | |
| SCHEMBL4599421 | 0.77 | MAOB (0.50) | APLNRNPC1PKMRAB9ATSHR | |
| SCHEMBL4610582 | 0.75 | ALDH1A1 (0.45) | APLNRDHFRNPC1PKMRAB9A | |
| SCHEMBL4710973 | 0.74 | APLNR (0.51) | APLNRHTR2ADHFRNPC1PKM | |
| SCHEMBL27972158 | 0.74 | APLNR (0.54) | APLNRHTR2AHTR2CDHFRNPC1 | |
| SCHEMBL27948920 | 0.72 | APLNR (0.69) | APLNRDHFRNPC1PKMRAB9A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1910320-A2 | INTERMEDIATE COMPOUND FOR SYNTHESIZING PHARMACEUTICAL AGENT AND PRODUCTION METHOD THEREOF | Mitsubishi Tanabe Pharma Corporation (JP) | 2008-04-16 | — | — | EP | claimed |
| WO-2007011065-A2 | INTERMEDIATE COMPOUND FOR SYNTHESIZING PHARMACEUTICAL AGENT AND PRODUCTION METHOD THEREOF | MITSUBISHI TANABE PHARMA CORPORATION (JP) | 2007-01-25 | — | — | WO | claimed |