Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 3/20 | 0.55 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.42 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.40 |
| ▸ | NOS3 | P29474 | 2/20 | 0.39 |
| ▸ | NOS1 | P29475 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | CA9 | Q16790 | 2/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA3 | P07451 | 1/20 | 0.39 |
| ▸ | CA6 | P23280 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7025558 | 1.00 | KIF11 (0.55) | KIF11CYP2A6ALDH1A1CYP19A1LOXL2 | |
| SCHEMBL7025554 | 1.00 | KIF11 (0.55) | KIF11CYP2A6ALDH1A1CYP19A1LOXL2 | |
| SCHEMBL156260 | 0.82 | KIF11 (0.59) | KIF11CYP2A6ALDH1A1CYP19A1LOXL2 | |
| SCHEMBL27915264 | 0.78 | CA1 (0.35) | KIF11CYP2A6ALDH1A1NOS1CA2 | |
| SCHEMBL27897735 | 0.78 | MEN1 (0.46) | KIF11CYP2A6CYP19A1TSHR | |
| SCHEMBL28801791 | 0.78 | KCNN4 (0.38) | KIF11ALDH1A1CYP19A1 | |
| SCHEMBL1918811 | 0.77 | KCNN4 (0.46) | ALDH1A1 | |
| SCHEMBL2683357 | 0.77 | KCNN4 (0.46) | ALDH1A1 | |
| SCHEMBL306585 | 0.77 | KIF11 (0.59) | KIF11CYP2A6ALDH1A1CYP19A1LOXL2 | |
| Hydrochloric Acid SCHEMBL5687819 | 0.77 | MEN1 (0.45) | KIF11CYP2A6CYP19A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-5939556-A | Hydantoin compounds, salts thereof, processes for their preparation, and processes for preparing pharmaceutically active compounds comprising them | HOECHST AKTIENGESELLSCHAFT (DE) | 1999-08-17 | — | — | US | disclosed |