Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.50 |
| ▸ | MAOA | P21397 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL28270361 | 0.72 | ALDH1A1 (0.69) | ALDH1A1MAOANPC1RAB9ABCHE | |
| SCHEMBL7611787 | 0.69 | ALDH1A1 (1.00) | ALDH1A1MAOANPC1RAB9ABCHE | |
| SCHEMBL23790313 | 0.66 | ALDH1A1 (0.73) | ALDH1A1MAOANPC1RAB9ABCHE | |
| Anthrone SCHEMBL29089221 | 0.64 | MAOA (0.69) | ALDH1A1MAOABCHECES1MAPT | |
| SCHEMBL10071738 | 0.64 | MAOA (0.57) | ALDH1A1MAOANPC1RAB9ABCHE | |
| SCHEMBL23839 | 0.64 | MAOA (0.57) | ALDH1A1MAOARAB9ABCHECES1 | |
| SCHEMBL14274025 | 0.63 | ALDH1A1 (0.68) | ALDH1A1MAOANPC1RAB9ABCHE | |
| SCHEMBL25634586 | 0.62 | TSHR (0.56) | ALDH1A1RAB9ACYP1A2CYP2A6TSHR | |
| Ethylene Glycol SCHEMBL18525381 | 0.62 | MAOA (0.49) | ALDH1A1MAOARAB9ABCHECES1 | |
| Phenanthrene SCHEMBL21219119 | 0.61 | TSHR (0.57) | ALDH1A1MAOANPC1RAB9ABCHE |
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-1721943-B1 | Ink composition, inkjet recording method, printed material, process for producing lithographic printing plate, and lithographic printing plate | FUJIFILM CORP (JP) | 2010-05-12 | — | — | EP | disclosed |