Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 4/20 | 0.48 |
| ▸ | CTSK | P43235 | 3/20 | 0.48 |
| ▸ | MIF | P14174 | 1/20 | 0.44 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.40 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.38 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.38 |
| ▸ | PPARA | Q07869 | 2/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 2/20 | 0.36 |
| ▸ | CA2 | P00918 | 2/20 | 0.36 |
| ▸ | CA7 | P43166 | 2/20 | 0.36 |
| ▸ | CA4 | P22748 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | GPR88 | Q9GZN0 | 1/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.35 |
| ▸ | CTSL | P07711 | 1/20 | 0.35 |
| ▸ | CTSB | P07858 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL806627 | 1.00 | CTSS (0.48) | CTSSCTSKMIFS1PR3GABRB1 | |
| SCHEMBL8258359 | 0.87 | CTSS (0.47) | CTSSCTSKS1PR3 | |
| SCHEMBL1115110 | 0.87 | NPSR1 (0.50) | CTSSCTSKS1PR3PPARAATM | |
| SCHEMBL5743400 | 0.86 | CTSK (0.63) | CTSSCTSKS1PR3GABRB1GABRB2 | |
| SCHEMBL3212586 | 0.86 | CTSK (0.63) | CTSSCTSKS1PR3GABRB1GABRB2 | |
| SCHEMBL15962588 | 0.86 | CTSS (0.49) | CTSSCTSKMIFS1PR3PPARA | |
| SCHEMBL191986 | 0.86 | CTSS (0.52) | CTSSCTSKMIFS1PR3PPARA | |
| SCHEMBL843924 | 0.86 | CTSS (0.52) | CTSSCTSKMIFS1PR3PPARA | |
| SCHEMBL3212595 | 0.86 | CTSK (0.63) | CTSSCTSKS1PR3GABRB1GABRB2 | |
| SCHEMBL191987 | 0.86 | CTSS (0.52) | CTSSCTSKMIFS1PR3PPARA |
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-4144391-A | REPLACING AN ACETOXY GROUP BY A SULFUR NUCLEOPHILE | ELI LILLY AND COMPANY (US) | 1979-03-13 | — | — | US | disclosed |