Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FAP | Q12884 | 3/20 | 0.48 |
| ▸ | DPP4 | P27487 | 1/20 | 0.48 |
| ▸ | PREP | P48147 | 1/20 | 0.48 |
| ▸ | CASP1 | P29466 | 9/20 | 0.44 |
| ▸ | CASP4 | P49662 | 1/20 | 0.44 |
| ▸ | CASP5 | P51878 | 1/20 | 0.44 |
| ▸ | CASP7 | P55210 | 1/20 | 0.44 |
| ▸ | CASP9 | P55211 | 1/20 | 0.44 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.44 |
| ▸ | CASP10 | Q92851 | 1/20 | 0.44 |
| ▸ | IL1B | P01584 | 2/20 | 0.40 |
| ▸ | TACR1 | P25103 | 1/20 | 0.40 |
| ▸ | F2 | P00734 | 2/20 | 0.38 |
| ▸ | PLG | P00747 | 1/20 | 0.38 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.38 |
| ▸ | GZMB | P10144 | 1/20 | 0.38 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.38 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL16281653 | 0.86 | CASP1 (0.45) | FAPDPP4PREPCASP1CASP4 | |
| SCHEMBL16381901 | 0.85 | FAP (0.46) | FAPDPP4PREPCASP1CASP4 | |
| SCHEMBL12949952 | 0.85 | FAP (0.46) | FAPDPP4PREPCASP1CASP4 | |
| SCHEMBL16381898 | 0.85 | CASP1 (0.46) | FAPDPP4PREPCASP1IL1B | |
| SCHEMBL3470684 | 0.85 | CASP1 (0.58) | FAPDPP4PREPCASP1CASP4 | |
| SCHEMBL13928423 | 0.85 | CASP1 (0.58) | FAPDPP4PREPCASP1CASP4 | |
| SCHEMBL12748071 | 0.84 | CASP1 (0.49) | CASP1CASP4CASP5CASP7CASP9 | |
| SCHEMBL16381888 | 0.83 | CASP1 (0.45) | FAPDPP4PREPCASP1IL1B | |
| SCHEMBL8288931 | 0.83 | CASP1 (0.44) | FAPDPP4PREPCASP1CASP4 | |
| SCHEMBL12950063 | 0.82 | CASP1 (0.44) | FAPDPP4PREPCASP1IL1B |
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-2005085236-A2 | CASPASE INHIBITORS AND USES THEREOF | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2005-09-15 | — | — | WO | disclosed |