Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 4/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 3/20 | 0.32 |
| ▸ | HTR7 | P34969 | 3/20 | 0.32 |
| ▸ | HTR1A | P08908 | 3/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | HTR6 | P50406 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16206238 | 0.82 | DRD2 (0.42) | ALDH1A1POLBMAPTHTTSMN1; SMN2 | |
| SCHEMBL14001906 | 0.72 | NPSR1 (0.46) | ALDH1A1POLBMAPTHTTSMN1; SMN2 | |
| SCHEMBL283988 | 0.72 | ALDH1A1 (0.52) | ALDH1A1POLBMAPTHTTSMN1; SMN2 | |
| Bromide SCHEMBL1608735 | 0.70 | ALDH1A1 (0.50) | ALDH1A1POLBMAPTHTTSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL28554078 | 0.70 | ALDH1A1 (0.50) | ALDH1A1POLBMAPTHTTSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL451487 | 0.70 | ALDH1A1 (0.50) | ALDH1A1POLBMAPTHTTSMN1; SMN2 | |
| SCHEMBL16206228 | 0.69 | HTR1A (0.42) | ALDH1A1POLBMAPTHTTSMN1; SMN2 | |
| SCHEMBL16206207 | 0.69 | ALDH1A1 (0.42) | ALDH1A1POLBMAPTHTTSMN1; SMN2 | |
| SCHEMBL20106885 | 0.68 | ALDH1A1 (0.60) | ALDH1A1POLBMAPTHTTSMN1; SMN2 | |
| SCHEMBL1232280 | 0.68 | DRD2 (0.34) | ALDH1A1POLBMAPTHTTSMN1; SMN2 |
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-2018087230-A1 | RUTHENIUM COMPLEXES USEFUL FOR CATALYZING METATHESIS REACTIONS | XIMO AG (CH) | 2018-05-17 | — | — | WO | disclosed |