Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.37 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | ELANE | P08246 | 1/20 | 0.34 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.34 |
| ▸ | C5 | P01031 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA4 | P22748 | 1/20 | 0.33 |
| ▸ | CA6 | P23280 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | PPARA | Q07869 | 1/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | STK17B | O94768 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | CRHR1 | P34998 | 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 | |
|---|---|---|---|---|
| SCHEMBL19476241 | 0.88 | CA1 (0.39) | CA1CA2 | |
| SCHEMBL17469676 | 0.86 | CES2 (0.40) | CYSLTR2CYSLTR1CNR2ELANECA1 | |
| SCHEMBL19476034 | 0.80 | CES2 (0.38) | CYSLTR2CYSLTR1CNR2ELANECES2 | |
| SCHEMBL19175928 | 0.77 | CA1 (0.45) | CA1CA2CA4CA6PPARG | |
| SCHEMBL19476244 | 0.76 | PSEN1 (0.46) | PPARG | |
| SCHEMBL19476058 | 0.72 | KDM4E (0.40) | CA1CA2CA4CA6CES2 | |
| SCHEMBL19476035 | 0.72 | CA1 (0.39) | CA1CA2 | |
| SCHEMBL19476245 | 0.71 | PSEN1 (0.42) | CA1CA2PPARG | |
| SCHEMBL19476171 | 0.70 | PARP15 (0.46) | CA1CA2CA4CA6 | |
| SCHEMBL19476170 | 0.70 | KDM4E (0.47) | ELANECA1CA2CA4CA6 |
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-2017180248-A1 | ENANTIOENRICHED VIRIDICATUMTOXIN B ANALOGS | WILLIAM MARSH RICE UNIVERSITY (US) | 2017-10-19 | — | — | WO | disclosed |