Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP8 | P22894 | 4/20 | 0.71 |
| ▸ | MMP13 | P45452 | 4/20 | 0.71 |
| ▸ | MMP3 | P08254 | 3/20 | 0.71 |
| ▸ | MMP1 | P03956 | 1/20 | 0.71 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.52 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.51 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.51 |
| ▸ | ADAM17 | P78536 | 2/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.50 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.50 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.50 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.50 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.50 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.50 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.50 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.50 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.50 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.50 |
| ▸ | MMP2 | P08253 | 2/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL11566606 | 0.94 | MMP8 (0.64) | MMP8MMP13MMP3MMP1PSIP1 | |
| SCHEMBL7212095 | 0.88 | MMP13 (0.68) | MMP8MMP13MMP3MMP1KEAP1 | |
| SCHEMBL1722036 | 0.86 | PSIP1 (0.56) | MMP8MMP13MMP3MMP1PSIP1 | |
| SCHEMBL10629823 | 0.86 | PSIP1 (0.61) | MMP8MMP13MMP3MMP1PSIP1 | |
| SCHEMBL576918 | 0.86 | KEAP1 (0.63) | MMP8MMP13MMP3MMP1PSIP1 | |
| SCHEMBL10626503 | 0.84 | HDAC1 (0.65) | MMP8MMP13MMP3MMP1PSIP1 | |
| SCHEMBL7208687 | 0.84 | MMP13 (1.00) | MMP8MMP13MMP3MMP1ADAM17 | |
| SCHEMBL7213456 | 0.84 | MMP13 (1.00) | MMP8MMP13MMP3MMP1KEAP1 | |
| SCHEMBL777601 | 0.81 | PSIP1 (0.67) | MMP8MMP13MMP3PSIP1KEAP1 | |
| SCHEMBL8972497 | 0.80 | PSIP1 (0.54) | MMP8MMP13MMP3MMP1PSIP1 |
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 |