Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
| ▸ | TDO2 | P48775 | 1/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | CXCR2 | P25025 | 3/20 | 0.34 |
| ▸ | CFTR | P13569 | 2/20 | 0.34 |
| ▸ | CXCR1 | P25024 | 2/20 | 0.34 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.33 |
| ▸ | CCR1 | P32246 | 1/20 | 0.33 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.31 |
| ▸ | TSPO | P30536 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL198230 | 1.00 | TSHR (0.50) | TSHRIDO1TDO2TRPA1DYRK1A | |
| SCHEMBL3497477 | 1.00 | TSHR (0.50) | TSHRIDO1TDO2TRPA1DYRK1A | |
| SCHEMBL13937393 | 0.84 | TSHR (0.61) | TSHRTRPA1ALDH1A1L3MBTL1 | |
| SCHEMBL7351692 | 0.78 | TSHR (0.50) | TSHRHTTCCR1ALDH1A1CYP3A4 | |
| SCHEMBL29413826 | 0.78 | CFTR (0.37) | TSHRIDO1TDO2HTTCFTR | |
| SCHEMBL3372946 | 0.76 | IDO1 (0.43) | TSHRIDO1TDO2HTTCFTR | |
| SCHEMBL11604556 | 0.76 | IDO1 (0.43) | TSHRIDO1TDO2HTTCFTR | |
| SCHEMBL5117680 | 0.76 | IDO1 (0.43) | TSHRIDO1TDO2HTTCFTR | |
| SCHEMBL5117761 | 0.76 | IDO1 (0.43) | TSHRIDO1TDO2HTTCFTR | |
| SCHEMBL3375814 | 0.76 | IDO1 (0.43) | TSHRIDO1TDO2HTTCFTR |
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-2004090124-A2 | SEQUENCES ENCODING S-HYDROXYNITRIL LYASES AND THEIR USE IN METHODS FOR THE PRODUCTION OF CYANOHYDRINS | BASF AKTIENGESELLSCHAFT (DE) | 2004-10-21 | — | — | WO | disclosed |