Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.60 |
| ▸ | ACHE | P22303 | 5/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 3/20 | 0.38 |
| ▸ | CA1 | P00915 | 2/20 | 0.38 |
| ▸ | CA9 | Q16790 | 2/20 | 0.38 |
| ▸ | CA5A | P35218 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | LPL | P06858 | 1/20 | 0.38 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.38 |
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.38 |
| ▸ | ORAI2 | Q96SN7 | 1/20 | 0.38 |
| ▸ | ORAI3 | Q9BRQ5 | 1/20 | 0.38 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1538359 | 0.88 | TSHR (0.67) | TSHRACHETDP1NPC1MAPT | |
| Water SCHEMBL9183302 | 0.84 | TSHR (0.38) | TSHRTDP1ALDH1A1KIF11LMNA | |
| Hydrogen Peroxide SCHEMBL25220009 | 0.81 | ESR1 (0.41) | TSHRTDP1MAPTALDH1A1LMNA | |
| SCHEMBL30374558 | 0.79 | TSHR (0.55) | TSHRACHETDP1NPC1MAPT | |
| SCHEMBL9407670 | 0.78 | TSHR (0.55) | TSHRACHETDP1ALDH1A1KIF11 | |
| SCHEMBL12597559 | 0.78 | TSHR (0.55) | TSHRACHETDP1NPC1MAPT | |
| SCHEMBL24136138 | 0.78 | TSHR (0.55) | TSHRACHETDP1NPC1MAPT | |
| SCHEMBL18556239 | 0.78 | TSHR (0.48) | TSHRACHETDP1NPC1MAPT | |
| SCHEMBL25622563 | 0.76 | TSHR (0.52) | TSHRACHETDP1CA2CA1 | |
| SCHEMBL4942966 | 0.75 | TSHR (0.67) | TSHRACHETDP1NPC1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-4204075-A | PURIFICATION | PENNWALT CORPORATION (US) | 1980-05-20 | — | — | US | disclosed |
| US-4133835-A | REACTING AN OLEFIN, A HALIDE, AND A HYDROPEROXIDE | PENNWALT CORPORATION (US) | 1979-01-09 | — | — | US | disclosed |