Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSK | P43235 | 1/20 | 0.40 |
| ▸ | F2 | P00734 | 4/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL7377699 | 1.00 | CTSK (0.40) | CTSKF2HDAC6CNR2NPY5R | |
| SCHEMBL7380915 | 0.91 | F2 (0.43) | F2 | |
| SCHEMBL7380912 | 0.91 | F2 (0.43) | F2 | |
| SCHEMBL8666366 | 0.89 | HDAC6 (0.45) | CTSKHDAC6CNR2NPY5RKDM4E | |
| SCHEMBL7377703 | 0.88 | CTSK (0.40) | CTSKF2HDAC6CNR2 | |
| SCHEMBL7380919 | 0.79 | F2 (0.43) | F2 | |
| SCHEMBL3298844 | 0.77 | F2 (0.52) | F2NPY5RKDM4E | |
| SCHEMBL7420368 | 0.76 | SLC1A3 (0.53) | F2NPY5R | |
| SCHEMBL7420373 | 0.76 | SLC1A3 (0.53) | F2NPY5R | |
| SCHEMBL6978879 | 0.73 | CTSK (0.50) | CTSKHDAC6KDM4ENPC1HSP90AA1 |
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-1996040742-A1 | PEPTIDYL HETEROCYCLES USEFUL IN THE TREATMENT OF THROMBIN RELATEDDISORDERS | ORTHO PHARMACEUTICAL CORPORATION (US) | 1996-12-19 | — | — | WO | claimed |