Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | LTA4H | P09960 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | FAAH | O00519 | 1/20 | 0.42 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.42 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.42 |
| ▸ | ELANE | P08246 | 1/20 | 0.42 |
| ▸ | PRTN3 | P24158 | 1/20 | 0.42 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.42 |
| ▸ | CA5A | P35218 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | DAO | P14920 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | NAMPT | P43490 | 1/20 | 0.41 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.39 |
| ▸ | LOX | P28300 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3179130 | 0.84 | TSHR (0.59) | TSHRHSD17B10MAPTLTA4HCA1 | |
| SCHEMBL5005563 | 0.82 | TSHR (0.57) | TSHRHSD17B10MAPTLTA4HCA1 | |
| Benzylsulfonylbenzene SCHEMBL780337 | 0.80 | TSHR (0.68) | TSHRHSD17B10MAPTLTA4HCA1 | |
| Benzylsulfonylbenzene SCHEMBL1877584 | 0.78 | TSHR (0.66) | TSHRHSD17B10MAPTLTA4HCA1 | |
| SCHEMBL4796460 | 0.77 | TSHR (0.59) | TSHRHSD17B10MAPTCA1CA2 | |
| SCHEMBL257997 | 0.76 | MAPT (0.64) | TSHRHSD17B10MAPTCA9LMNA | |
| SCHEMBL5081823 | 0.76 | TSHR (0.62) | TSHRHSD17B10MAPTLTA4HCA1 | |
| SCHEMBL1939695 | 0.76 | TSHR (0.62) | TSHRHSD17B10MAPTLTA4HCA1 | |
| SCHEMBL2921402 | 0.76 | TSHR (0.68) | TSHRHSD17B10MAPTLTA4HCA1 | |
| SCHEMBL160854 | 0.76 | TSHR (0.62) | TSHRHSD17B10MAPTCA1CA2 |
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-3227282-B1 | NOVEL PIPERIDINE DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2019-04-03 | — | — | EP | disclosed |