Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADAM17 | P78536 | 16/20 | 0.40 |
| ▸ | MMP13 | P45452 | 11/20 | 0.40 |
| ▸ | MMP2 | P08253 | 8/20 | 0.40 |
| ▸ | MMP1 | P03956 | 4/20 | 0.38 |
| ▸ | MMP9 | P14780 | 4/20 | 0.38 |
| ▸ | MMP14 | P50281 | 4/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.35 |
| ▸ | ITGA2B | P08514 | 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 | |
|---|---|---|---|---|
| SCHEMBL6264852 | 0.80 | ADAM17 (0.55) | ADAM17MMP13MMP2MMP1MMP9 | |
| SCHEMBL6263133 | 0.75 | ADAM17 (0.49) | ADAM17MMP13MMP2MMP1MMP9 | |
| SCHEMBL6265331 | 0.67 | ADAM17 (0.56) | ADAM17MMP13MMP2MMP1MMP9 | |
| SCHEMBL6265285 | 0.66 | MMP13 (0.51) | ADAM17MMP13MMP2MMP1MMP9 | |
| SCHEMBL6265588 | 0.66 | ADAM17 (0.49) | ADAM17MMP13MMP2MMP1MMP9 | |
| SCHEMBL7356262 | 0.65 | ADAM17 (0.59) | ADAM17MMP13MMP2MMP1MMP9 | |
| SCHEMBL7360886 | 0.65 | ADAM17 (0.61) | ADAM17MMP13MMP2MMP1MMP9 | |
| SCHEMBL6266377 | 0.65 | ADAM17 (0.61) | ADAM17MMP13MMP2MMP1MMP9 | |
| SCHEMBL3937356 | 0.64 | ADAM17 (0.50) | ADAM17MMP13MMP1MMP9 | |
| SCHEMBL7363135 | 0.64 | ADAM17 (0.51) | ADAM17MMP13MMP2MMP1MMP9 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1147085-A1 | ALKYNYL CONTAINING HYDROXAMIC ACID DERIVATIVES, THEIR PREPARATION AND THEIR USE AS MATRIX METALLOPROTEINASE (MMP) INHIBITORS / TNF-ALPHA CONVERTING ENZYME (TACE) INHIBITORS | American Cyanamid Company (US) | 2001-10-24 | — | — | EP | disclosed |
| WO-2000044723-A1 | ALKYNYL CONTAINING HYDROXAMIC ACID DERIVATIVES, THEIR PREPARATION AND THEIR USE AS MATRIX METALLOPROTEINASE (MMP) INHIBITORS/TNF-ALPHA CONVERTING ENZYME (TACE) INHIBITORS | AMERICAN CYANAMID COMPANY (US) | 2000-08-03 | — | — | WO | disclosed |