Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | 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 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 3/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL522175 | 0.82 | TSHR (0.61) | TSHRMAPK1MAPTCA12CA1 | |
| SCHEMBL1719721 | 0.80 | TSHR (0.59) | TSHRMAPK1MAPTCA12CA1 | |
| SCHEMBL757647 | 0.80 | CES2 (0.37) | TSHRMAPK1LMNASMN1; SMN2HTT | |
| SCHEMBL27511609 | 0.79 | TSHR (0.53) | TSHRMAPK1MAPTCA12CA1 | |
| SCHEMBL7198377 | 0.78 | TSHR (0.57) | TSHRMAPK1MAPTCA12CA1 | |
| SCHEMBL29154303 | 0.77 | TSHR (0.52) | TSHRMAPK1MAPTCA12CA1 | |
| SCHEMBL522412 | 0.75 | TSHR (0.53) | TSHRMAPK1MAPTCA12CA1 | |
| SCHEMBL2878001 | 0.74 | TSHR (0.53) | TSHRMAPK1MAPTCA12CA1 | |
| SCHEMBL523604 | 0.74 | TSHR (0.53) | TSHRMAPK1MAPTCA12CA1 | |
| SCHEMBL9872913 | 0.73 | KMT2A (0.41) | 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 |