Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.48 |
| ▸ | TK1 | P04183 | 1/20 | 0.43 |
| ▸ | IDO1 | P14902 | 1/20 | 0.43 |
| ▸ | AGXT | P21549 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | CA1 | P00915 | 3/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | CA7 | P43166 | 2/20 | 0.37 |
| ▸ | CA9 | Q16790 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | TACR1 | P25103 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL20749143 | 0.87 | TSHR (0.50) | TSHRALOX5TK1IDO1AGXT | |
| SCHEMBL10515956 | 0.84 | TSHR (0.56) | TSHRALOX5TK1IDO1AGXT | |
| SCHEMBL18789226 | 0.84 | TSHR (0.56) | TSHRALOX5TK1IDO1AGXT | |
| SCHEMBL9084784 | 0.84 | TSHR (0.56) | TSHRALOX5TK1IDO1AGXT | |
| SCHEMBL1524098 | 0.83 | TSHR (0.67) | TSHRALOX5TK1IDO1AGXT | |
| SCHEMBL1524101 | 0.83 | TSHR (0.67) | TSHRALOX5TK1IDO1AGXT | |
| SCHEMBL1524411 | 0.83 | TSHR (0.67) | TSHRALOX5TK1IDO1AGXT | |
| Ammonia Solution, Strong SCHEMBL7095980 | 0.81 | TSHR (0.64) | TSHRALOX5TK1IDO1AGXT | |
| SCHEMBL6633910 | 0.81 | TSHR (0.52) | TSHRALOX5TK1IDO1AGXT | |
| SCHEMBL7266237 | 0.81 | TSHR (0.52) | TSHRALOX5TK1IDO1AGXT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016058144-A1 | PREPARATION AND USE OF CYCLIC SULFONAMIDE DERIVATIVES AS PAR-1 RECEPTOR ANTAGONISTS | MERCK SHARP & DOHME CORP. (US) | 2016-04-21 | — | — | WO | disclosed |