Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADAM17 | P78536 | 10/20 | 0.56 |
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | MMP13 | P45452 | 8/20 | 0.48 |
| ▸ | MMP1 | P03956 | 6/20 | 0.48 |
| ▸ | MMP9 | P14780 | 5/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.47 |
| ▸ | MEN1 | O00255 | 5/20 | 0.47 |
| ▸ | MMP2 | P08253 | 3/20 | 0.46 |
| ▸ | MMP14 | P50281 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL6266879 | 0.81 | ADAM17 (0.77) | ADAM17HTTSMN1; SMN2CYP1A2CYP3A4 | |
| SCHEMBL7360808 | 0.76 | ADAM17 (0.56) | ADAM17MMP13MMP1MMP9MMP2 | |
| SCHEMBL6265309 | 0.75 | ADAM17 (0.65) | ADAM17HTTSMN1; SMN2CYP1A2CYP3A4 | |
| SCHEMBL6265256 | 0.75 | MEN1 (0.71) | ADAM17HTTSMN1; SMN2CYP1A2CYP3A4 | |
| SCHEMBL6263838 | 0.74 | ADAM17 (0.77) | ADAM17HTTSMN1; SMN2CYP1A2CYP3A4 | |
| SCHEMBL6262677 | 0.74 | ADAM17 (0.79) | ADAM17HTTSMN1; SMN2CYP1A2CYP3A4 | |
| SCHEMBL6268249 | 0.74 | ADAM17 (0.66) | ADAM17HTTSMN1; SMN2CYP1A2CYP3A4 | |
| SCHEMBL6262910 | 0.73 | ADAM17 (0.79) | ADAM17HTTSMN1; SMN2CYP1A2CYP3A4 | |
| SCHEMBL6265700 | 0.73 | ADAM17 (0.83) | ADAM17HTTSMN1; SMN2CYP1A2CYP3A4 | |
| SCHEMBL6864846 | 0.73 | ADAM17 (0.79) | ADAM17HTTSMN1; SMN2CYP1A2CYP3A4 |
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 |