Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | LTA4H | P09960 | 2/20 | 0.35 |
| ▸ | LPAR1 | Q92633 | 2/20 | 0.35 |
| ▸ | LPAR5 | Q9H1C0 | 2/20 | 0.35 |
| ▸ | MET | P08581 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7686803 | 0.91 | ALDH1A1 (0.39) | ALDH1A1CYP1A2CYP2D6MAPTCYP2C9 | |
| SCHEMBL6478360 | 0.89 | MAPT (0.39) | ALDH1A1CYP1A2CYP2D6MAPTCYP2C9 | |
| SCHEMBL7692913 | 0.89 | LPAR1 (0.39) | ALDH1A1CYP1A2CYP2D6MAPTCYP2C9 | |
| SCHEMBL7693347 | 0.89 | MET (0.35) | ALDH1A1CYP1A2CYP2D6MAPTCYP2C9 | |
| SCHEMBL7688923 | 0.88 | MAPT (0.38) | ALDH1A1CYP1A2CYP2D6MAPTCYP2C9 | |
| SCHEMBL7693606 | 0.87 | F2 (0.37) | ALDH1A1CYP1A2CYP2D6MAPTCYP2C9 | |
| SCHEMBL7686564 | 0.86 | LPAR1 (0.43) | ALDH1A1CYP1A2CYP2D6MAPTCYP2C9 | |
| SCHEMBL7692398 | 0.85 | ADRB3 (0.45) | MAPTMET | |
| Hydrochloric Acid SCHEMBL7686435 | 0.85 | ADRB3 (0.44) | MAPTMET | |
| SCHEMBL6488702 | 0.84 | LPAR1 (0.39) | ALDH1A1CYP1A2CYP2D6MAPTCYP2C9 |
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-2002000622-A2 | AMINOALCOHOL DERIVATIVES | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2002-01-03 | — | — | WO | disclosed |