Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP8 | P22894 | 4/20 | 0.63 |
| ▸ | MMP13 | P45452 | 4/20 | 0.63 |
| ▸ | MMP3 | P08254 | 3/20 | 0.63 |
| ▸ | MMP1 | P03956 | 1/20 | 0.63 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | MMP2 | P08253 | 2/20 | 0.40 |
| ▸ | MMP9 | P14780 | 2/20 | 0.40 |
| ▸ | MMP14 | P50281 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 3/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.39 |
| ▸ | HDAC10 | Q969S8 | 3/20 | 0.39 |
| ▸ | HDAC11 | Q96DB2 | 3/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.39 |
| ▸ | HDAC9 | Q9UKV0 | 3/20 | 0.39 |
| ▸ | HDAC5 | Q9UQL6 | 3/20 | 0.39 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL18184670 | 0.78 | RIPK1 (0.47) | CASP1RIPK1SLC6A2SLC6A4LMNA | |
| SCHEMBL7208687 | 0.78 | MMP13 (1.00) | MMP8MMP13MMP3MMP1MMP2 | |
| SCHEMBL12748077 | 0.74 | MMP8 (0.75) | MMP8MMP13MMP3MMP1MMP2 | |
| SCHEMBL146565 | 0.74 | CASP1 (0.50) | MMP8MMP13MMP3CASP1MMP2 | |
| SCHEMBL502864 | 0.74 | CASP1 (0.50) | MMP8MMP13MMP3CASP1MMP2 | |
| SCHEMBL17038517 | 0.73 | CASP1 (0.42) | MMP13CASP1MMP2RIPK1LMNA | |
| SCHEMBL7212096 | 0.72 | MMP8 (0.47) | MMP8MMP13MMP3MMP1CASP1 | |
| SCHEMBL11599660 | 0.72 | CASP1 (0.49) | MMP8MMP13MMP3CASP1MMP2 | |
| Ammonia Solution, Strong SCHEMBL502557 | 0.72 | CASP1 (0.49) | MMP8MMP13MMP3CASP1MMP2 | |
| SCHEMBL569758 | 0.71 | SOS1 (0.55) | CASP1LMNAGAAKMT2APTGS2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0939628-B1 | THIOL SULFONE METALLOPROTEASE INHIBITORS | MONSANTO CO (US) | 2003-03-05 | — | — | EP | disclosed |
| US-6013649-A | BOND DISORDERS; AUTOIMMUNE DISEASES; ANTITUMOR AGENTS | MONSANTO COMPANY (US) | 2000-01-11 | — | — | US | disclosed |
| EP-0939628-A4 | THIOL SULFONE METALLOPROTEASE INHIBITORS | MONSANTO CO (US) | 1999-12-22 | — | — | EP | disclosed |
| EP-0939628-A1 | THIOL SULFONE METALLOPROTEASE INHIBITORS | MONSANTO COMPANY (US) | 1999-09-08 | — | — | EP | disclosed |
| WO-1998003164-A1 | THIOL SULFONE METALLOPROTEASE INHIBITORS | MONSANTO COMPANY (US) | 1998-01-29 | — | — | WO | disclosed |