Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.47 |
| ▸ | BACE1 | P56817 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | PNMT | P11086 | 1/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.41 |
| ▸ | IGF1R | P08069 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA4 | P22748 | 1/20 | 0.38 |
| ▸ | CA6 | P23280 | 1/20 | 0.38 |
| ▸ | CA5A | P35218 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.38 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2299809 | 1.00 | ALDH1A1 (0.47) | ALDH1A1MAPTGAAKDM4EALOX5 | |
| SCHEMBL15921609 | 0.83 | KDM4E (0.47) | ALDH1A1MAPTGAAKDM4EALOX5 | |
| SCHEMBL29973253 | 0.83 | RECQL (0.42) | ALDH1A1MAPTGAAALOX15MEN1 | |
| SCHEMBL2522185 | 0.83 | RECQL (0.42) | ALDH1A1MAPTGAAALOX15MEN1 | |
| SCHEMBL2294256 | 0.81 | PNMT (0.42) | ALDH1A1MAPTGAAPNMTTAAR1 | |
| SCHEMBL10756643 | 0.80 | KDM4E (0.52) | ALDH1A1MAPTGAAKDM4EALOX5 | |
| SCHEMBL908524 | 0.80 | PNMT (0.61) | ALDH1A1MAPTGAAKDM4EALOX5 | |
| SCHEMBL17186197 | 0.79 | TAAR1 (0.67) | ALDH1A1MAPTGAAKDM4EPNMT | |
| SCHEMBL11974004 | 0.79 | CNR1 (0.44) | ALDH1A1MAPTGAAKDM4ECA2 | |
| SCHEMBL31511753 | 0.77 | FFAR1 (0.51) | CA2CA1MAOB |
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 |
|---|---|---|---|---|---|---|---|
| CN-110225911-B | Oxadiazolone transient receptor potential channel inhibitors | 豪夫迈·罗氏有限公司 | 2022-04-05 | — | — | CN | disclosed |