Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1B | P28222 | 3/20 | 0.50 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.40 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | UTS2R | Q9UKP6 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8482513 | 0.99 | HTR1B (0.49) | HTR1BAOC3KDM4EMEN1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL1133376 | 0.85 | CDYL (0.45) | HTR1BKDM4EMEN1ALDH1A1KMT2A | |
| SCHEMBL9770334 | 0.83 | CYP2C19 (0.48) | AOC3KDM4EMEN1ALDH1A1KMT2A | |
| SCHEMBL8481171 | 0.82 | KMT2A (0.43) | HTR1BAOC3KDM4EMEN1ALDH1A1 | |
| SCHEMBL8481811 | 0.81 | HTR1B (0.46) | HTR1BAOC3KDM4EMEN1ALDH1A1 | |
| SCHEMBL18860719 | 0.80 | HTR1B (0.45) | HTR1BAOC3ALDH1A1TSHRUTS2R | |
| SCHEMBL8673517 | 0.80 | CYP2C19 (0.46) | HTR1BAOC3KDM4EMEN1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL8480126 | 0.80 | EP300 (0.42) | HTR1BKDM4EMEN1ALDH1A1KMT2A | |
| SCHEMBL9047997 | 0.80 | HTR2A (0.35) | HTR1BKDM4EALDH1A1TSHR | |
| SCHEMBL8481984 | 0.79 | UTS2R (0.44) | HTR1BAOC3KDM4EMEN1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5612381-A | 1,2-ethanediol derivative and salt thereof process for producing the same, and cerebral function-improving agent comprising the same | TOYAMA CHEMICAL CO., LTD. (JP) | 1997-03-18 | — | — | US | disclosed |