Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA2D1 | P54289 | 2/20 | 0.38 |
| ▸ | CACNB3 | P54284 | 1/20 | 0.38 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.38 |
| ▸ | PGR | P06401 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | CACNA2D2 | Q9NY47 | 1/20 | 0.38 |
| ▸ | BHMT | Q93088 | 1/20 | 0.35 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.35 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.35 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.33 |
| ▸ | PGD | P52209 | 1/20 | 0.32 |
| ▸ | MMP1 | P03956 | 1/20 | 0.32 |
| ▸ | MMP2 | P08253 | 1/20 | 0.32 |
| ▸ | MMP3 | P08254 | 1/20 | 0.32 |
| ▸ | MMP9 | P14780 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL16755874 | 0.82 | FFAR1 (0.36) | CACNA2D1CACNB3CACNA1CPGRADRA1A | |
| SCHEMBL29074727 | 0.78 | TSHR (0.36) | CACNA2D1CACNB3CACNA1CPGRADRA1A | |
| Succinic Acid SCHEMBL2961965 | 0.78 | EGLN1 (0.47) | SLC22A6TSHR | |
| Acetic Acid SCHEMBL5698774 | 0.78 | TSHR (0.46) | TSHRTDP1ALDH1A1 | |
| SCHEMBL207239 | 0.76 | — | — | |
| SCHEMBL25350353 | 0.75 | TSHR (0.39) | TSHRALDH1A1MMP1MMP2MMP3 | |
| SCHEMBL19341237 | 0.75 | CA1 (0.41) | BHMTITGB3ITGA2BSLC22A6TSHR | |
| SCHEMBL11445389 | 0.75 | PLA2G2C (0.42) | TSHRALDH1A1MMP9MMP13 | |
| SCHEMBL258152 | 0.74 | SLC22A6 (0.50) | CACNA2D1CACNB3CACNA1CPGRADRA1A | |
| SCHEMBL13863992 | 0.74 | TSHR (0.41) | CACNA2D1CACNB3CACNA1CPGRADRA1A |
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-4347379-A | REACTING AN ALCOHOL OF THIOL, A HALOFORM, ALKALI METAL HYDROXIDE, AND PHASE TRANSFER AGENT | THE B. F. GOODRICH COMPANY (US) | 1982-08-31 | — | — | US | disclosed |