Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | BDKRB1 | P46663 | 1/20 | 0.30 |
| ▸ | RECQL | P46063 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20766725 | 0.79 | AKR1C1 (0.35) | — | |
| SCHEMBL522175 | 0.77 | TSHR (0.61) | TSHRMAPK1CA12CA1CA2 | |
| SCHEMBL9873422 | 0.76 | KMT2A (0.38) | TSHRMAPK1CA12CA1CA2 | |
| SCHEMBL1719721 | 0.74 | TSHR (0.59) | TSHRMAPK1CA12CA1CA2 | |
| SCHEMBL27511609 | 0.73 | TSHR (0.53) | TSHRMAPK1CA12CA1CA2 | |
| SCHEMBL7198377 | 0.72 | TSHR (0.57) | TSHRMAPK1CA12CA1CA2 | |
| SCHEMBL29154303 | 0.71 | TSHR (0.52) | TSHRMAPK1CA12CA1CA2 | |
| SCHEMBL20767012 | 0.71 | AKR1C1 (0.42) | TSHR | |
| SCHEMBL522412 | 0.70 | TSHR (0.53) | TSHRMAPK1CA12CA1CA2 | |
| SCHEMBL2878001 | 0.69 | TSHR (0.53) | TSHRMAPK1CA12CA1CA2 |
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-4990508-A | Reduced side effects | TOYAMA CHEMICAL CO., LTD. (JP) | 1991-02-05 | — | — | US | disclosed |