Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA4 | P22748 | 1/20 | 0.36 |
| ▸ | CA6 | P23280 | 1/20 | 0.36 |
| ▸ | CA5A | P35218 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.36 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | PDE2A | O00408 | 2/20 | 0.32 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.32 |
| ▸ | BRAF | P15056 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL15058291 | 0.82 | SLC6A4 (0.35) | ALDH1A1GAAPDK2RAB9APDE2A | |
| SCHEMBL15057255 | 0.79 | NOTUM (0.32) | ALDH1A1MAPT | |
| SCHEMBL15056976 | 0.78 | TDP1 (0.43) | ALDH1A1GAARAB9A | |
| SCHEMBL15057124 | 0.76 | HPGD (0.45) | ALDH1A1RAB9A | |
| SCHEMBL7973952 | 0.74 | PPARA (0.51) | ALDH1A1MAPT | |
| SCHEMBL519232 | 0.73 | ALDH1A1 (0.46) | CA12CA1CA2CA4CA6 | |
| SCHEMBL31119678 | 0.72 | CYP3A4 (0.50) | ALDH1A1GAARAB9ASLC6A2MAPK1 | |
| SCHEMBL6036414 | 0.72 | ELANE (0.53) | HDAC1HDAC6CA2 | |
| SCHEMBL7991796 | 0.71 | HDAC1 (0.40) | HDAC1HDAC6ALDH1A1GAAMAPT | |
| SCHEMBL9487472 | 0.69 | ALDH1A1 (0.42) | HDAC1HDAC6CA12CA1CA2 |
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-2885296-B1 | PROCESS FOR MANUFACTURING BENZOXAZINONES | BASF SE (DE) | 2016-06-29 | — | — | EP | disclosed |