Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | GNG2 | P59768 | 1/20 | 0.39 |
| ▸ | GNB1 | P62873 | 1/20 | 0.39 |
| ▸ | NQO1 | P15559 | 6/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | KIF11 | P52732 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 6/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.34 |
| ▸ | MAPT | P10636 | 4/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.34 |
| ▸ | HPGD | P15428 | 3/20 | 0.34 |
| ▸ | GLA | P06280 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | CASP1 | P29466 | 1/20 | 0.34 |
| ▸ | CASP7 | P55210 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL28781324 | 0.90 | ALDH1A1 (0.36) | CA1CA9GNG2GNB1NQO1 | |
| SCHEMBL27579712 | 0.88 | MAPT (0.35) | CA1CA9NQO1KMT2AALDH1A1 | |
| SCHEMBL27768360 | 0.88 | MAPT (0.35) | CA1CA9NQO1KMT2AALDH1A1 | |
| SCHEMBL28815404 | 0.88 | MAPT (0.35) | CA1CA9NQO1KMT2AALDH1A1 | |
| SCHEMBL27839700 | 0.87 | CA1 (0.36) | CA1CA9GNG2GNB1NQO1 | |
| SCHEMBL27584193 | 0.87 | GNG2 (0.47) | GNG2GNB1NQO1KMT2AKIF11 | |
| SCHEMBL27735209 | 0.86 | CA1 (0.32) | CA1CA9NQO1 | |
| SCHEMBL27579758 | 0.86 | CA1 (0.32) | CA1CA9NQO1 | |
| SCHEMBL27548639 | 0.84 | ALDH1A1 (0.39) | CA1CA9NQO1KMT2ATSHR | |
| SCHEMBL28808709 | 0.83 | CA1 (0.35) | CA1CA9KMT2ATSHRALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1051758-C | Anti-androgenic cyclo and bicyclo alkenes | COSMOS PHARM CORP (US) | 2000-04-26 | — | — | CN | disclosed |
| CN-1091733-A | The cycloolefin of antiandrogen and bicyclic alkene | COSMOS PHARM CORP (US) | 1994-09-07 | — | — | CN | disclosed |