Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 4/20 | 0.49 |
| ▸ | BCHE | P06276 | 3/20 | 0.49 |
| ▸ | HTR2A | P28223 | 2/20 | 0.47 |
| ▸ | HTR2C | P28335 | 2/20 | 0.47 |
| ▸ | HTR2B | P41595 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | USP2 | O75604 | 2/20 | 0.43 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.43 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL161260 | 0.88 | BACE1 (0.62) | BACE1BCHEHTR2AHTR2CHTR2B | |
| SCHEMBL3455222 | 0.88 | BACE1 (0.62) | BACE1BCHEHTR2AHTR2CHTR2B | |
| SCHEMBL8276492 | 0.88 | BACE1 (0.62) | BACE1BCHEHTR2AHTR2CHTR2B | |
| Hydrochloric Acid SCHEMBL2499284 | 0.87 | BACE1 (0.61) | BACE1BCHEHTR2AHTR2CHTR2B | |
| SCHEMBL3354800 | 0.84 | TAAR1 (0.46) | KDM4ETAAR1OPRM1 | |
| Formic Acid SCHEMBL5928562 | 0.84 | BACE1 (0.60) | BACE1BCHEHTR2AHTR2CHTR2B | |
| SCHEMBL4044665 | 0.83 | ANPEP (0.55) | BCHECYP3A4CYP1A2CYP2D6TSHR | |
| SCHEMBL496056 | 0.83 | ANPEP (0.55) | BCHECYP3A4CYP1A2CYP2D6TSHR | |
| SCHEMBL3347864 | 0.83 | ANPEP (0.55) | BCHECYP3A4CYP1A2CYP2D6TSHR | |
| SCHEMBL4696783 | 0.83 | ANPEP (0.55) | BCHECYP3A4CYP1A2CYP2D6TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-1567488-B1 | HYDROXYETHYLAMINE DERIVATIVES FOR THE TREATMENT OF ALZHEIMER'S DISEASE | GLAXO GROUP LTD (GB) | 2007-02-21 | — | — | EP | disclosed |