Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 11/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 1/20 | 0.33 |
| ▸ | MMP13 | P45452 | 5/20 | 0.33 |
| ▸ | MMP1 | P03956 | 4/20 | 0.33 |
| ▸ | MMP2 | P08253 | 4/20 | 0.33 |
| ▸ | MMP9 | P14780 | 4/20 | 0.32 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.32 |
| ▸ | MMP3 | P08254 | 3/20 | 0.32 |
| ▸ | MMP8 | P22894 | 3/20 | 0.32 |
| ▸ | MMP7 | P09237 | 2/20 | 0.32 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.32 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.32 |
| ▸ | PHGDH | O43175 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6205249 | 0.86 | HDAC1 (0.34) | ADAMTS5HDAC1CYP3A4CA12CA1 | |
| SCHEMBL6227798 | 0.83 | MMP2 (0.40) | ADAMTS5CA12CA1CA2CA9 | |
| SCHEMBL8312446 | 0.79 | MMP13 (0.40) | MMP13MMP1MMP2MMP9ADAM17 | |
| Hydrochloric Acid SCHEMBL6206309 | 0.79 | MMP13 (0.40) | MMP13MMP1MMP2MMP9ADAM17 | |
| SCHEMBL6206551 | 0.77 | MMP13 (0.32) | CYP3A4MMP13MMP1MMP2MMP9 | |
| SCHEMBL8321170 | 0.76 | MMP1 (0.31) | CYP3A4MMP13MMP1MMP2MMP9 | |
| SCHEMBL8312448 | 0.76 | MMP13 (0.53) | MMP13MMP1MMP2MMP9ADAM17 | |
| Hydrochloric Acid SCHEMBL6206150 | 0.75 | MMP13 (0.52) | MMP13MMP1MMP2MMP9ADAM17 | |
| SCHEMBL8313897 | 0.72 | MMP2 (0.32) | CA12CA1CA2CA9MMP13 | |
| SCHEMBL6205988 | 0.71 | MMP2 (0.38) | CYP3A4CA12CA1CA2CA9 |
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-2004048368-A2 | HETEROARYLSULFONYLMETHYL HYDROXAMIC ACIDS AND AMIDES AND THEIR USE AS PROTEASE INHIBITORS | PHARMACIA CORPORATION (US) | 2004-06-10 | — | — | WO | disclosed |