Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FAP | Q12884 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MMP2 | P08253 | 1/20 | 0.32 |
| ▸ | MMP9 | P14780 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.30 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16938974 | 0.93 | FAP (0.34) | FAPTSHRMMP2MMP9HDAC1 | |
| SCHEMBL16938890 | 0.88 | FAP (0.32) | FAPTSHRHDAC1HDAC4 | |
| SCHEMBL16938907 | 0.88 | FAP (0.32) | FAPTSHRHDAC1HDAC4 | |
| SCHEMBL16938902 | 0.87 | HDAC4 (0.32) | FAPTSHRHDAC1HDAC4 | |
| SCHEMBL13340502 | 0.85 | FAP (0.32) | FAP | |
| SCHEMBL16938889 | 0.85 | CTSB (0.40) | FAPHDAC1HDAC4 | |
| SCHEMBL16639051 | 0.81 | — | — | |
| SCHEMBL16938908 | 0.78 | TSHR (0.34) | FAPTSHRHDAC1HDAC4 | |
| SCHEMBL8006962 | 0.76 | DPP4 (0.34) | — | |
| SCHEMBL11975943 | 0.76 | ADRB3 (0.35) | TSHRHDAC1HDAC4 |
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-2010068761-A2 | 4-AMINO-4-OXOBUTANOYL PEPTIDE CYCLIC ANALOGUES, INHIBITORS OF VIRAL REPLICATION | ACHILLION PHARMACEUTICALS, INC. (US) | 2010-06-17 | — | — | WO | disclosed |