Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP13 | P45452 | 6/20 | 0.69 |
| ▸ | MMP8 | P22894 | 4/20 | 0.69 |
| ▸ | ADAM17 | P78536 | 3/20 | 0.65 |
| ▸ | MMP2 | P08253 | 2/20 | 0.65 |
| ▸ | MMP9 | P14780 | 1/20 | 0.65 |
| ▸ | MMP1 | P03956 | 3/20 | 0.60 |
| ▸ | MMP3 | P08254 | 2/20 | 0.60 |
| ▸ | TSHR | P16473 | 4/20 | 0.58 |
| ▸ | CA12 | O43570 | 3/20 | 0.58 |
| ▸ | CA1 | P00915 | 3/20 | 0.58 |
| ▸ | CA2 | P00918 | 3/20 | 0.58 |
| ▸ | CA9 | Q16790 | 3/20 | 0.58 |
| ▸ | CA7 | P43166 | 2/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | RECQL | P46063 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | HTT | P42858 | 3/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7212036 | 0.95 | MMP13 (0.67) | MMP13MMP8ADAM17MMP2MMP9 | |
| SCHEMBL25901928 | 0.84 | MMP1 (0.59) | MMP13MMP8ADAM17MMP2MMP9 | |
| SCHEMBL7208418 | 0.84 | MMP1 (0.63) | MMP13MMP8ADAM17MMP2MMP9 | |
| SCHEMBL15060917 | 0.83 | CA12 (0.70) | MMP13MMP2MMP1TSHRCA12 | |
| SCHEMBL5384277 | 0.82 | MMP1 (0.61) | MMP13MMP2MMP1TSHRCA12 | |
| SCHEMBL5388006 | 0.82 | MMP1 (0.61) | MMP13MMP2MMP1TSHRCA12 | |
| SCHEMBL7207682 | 0.82 | MMP8 (0.67) | MMP13MMP8ADAM17MMP2MMP9 | |
| SCHEMBL7076532 | 0.81 | MMP13 (1.00) | MMP13MMP8ADAM17MMP2MMP9 | |
| SCHEMBL8798490 | 0.81 | CA12 (0.58) | MMP13MMP8ADAM17MMP2MMP9 | |
| SCHEMBL6743970 | 0.81 | TSHR (0.68) | MMP13MMP2MMP1TSHRCA12 |
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 |