Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA3 | P07451 | 1/20 | 0.50 |
| ▸ | CA6 | P23280 | 1/20 | 0.50 |
| ▸ | CA5A | P35218 | 1/20 | 0.50 |
| ▸ | CA9 | Q16790 | 1/20 | 0.50 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.50 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | NR3C1 | P04150 | 2/20 | 0.33 |
| ▸ | PGR | P06401 | 2/20 | 0.33 |
| ▸ | NR3C2 | P08235 | 2/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.33 |
| ▸ | DAO | P14920 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | IDO1 | P14902 | 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 | |
|---|---|---|---|---|
| SCHEMBL17696928 | 0.82 | CA3 (0.44) | CA3CA6CA5ACA9CA14 | |
| SCHEMBL29427775 | 0.79 | CA3 (0.52) | CA3CA6CA5ACA9CA14 | |
| SCHEMBL4343525 | 0.79 | CA3 (0.52) | CA3CA6CA5ACA9CA14 | |
| SCHEMBL12731992 | 0.77 | ALDH1A1 (0.54) | CA3CA6CA5ACA9CA14 | |
| SCHEMBL11550172 | 0.76 | ALDH1A1 (0.42) | CA3CA6CA5ACA9CA14 | |
| SCHEMBL31433155 | 0.76 | ALDH1A1 (0.42) | CA3CA6CA5ACA9CA14 | |
| SCHEMBL31297347 | 0.74 | TSHR (0.60) | CA3CA6CA5ACA9CA14 | |
| SCHEMBL3978795 | 0.74 | TSHR (0.60) | CA3CA6CA5ACA9CA14 | |
| SCHEMBL17414239 | 0.72 | IDO1 (0.33) | CA3CA6CA5ACA9CA14 | |
| SCHEMBL30965844 | 0.71 | CA3 (0.42) | CA3CA6CA5ACA9CA14 |
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-2016059242-A2 | TRACERS | INSTITUTT FOR ENERGITEKNIKK (NO) | 2016-04-21 | — | — | WO | disclosed |