Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP2 | P08253 | 4/20 | 0.41 |
| ▸ | MMP9 | P14780 | 4/20 | 0.41 |
| ▸ | MMP1 | P03956 | 2/20 | 0.39 |
| ▸ | MMP3 | P08254 | 2/20 | 0.39 |
| ▸ | MMP8 | P22894 | 2/20 | 0.39 |
| ▸ | MMP14 | P50281 | 2/20 | 0.39 |
| ▸ | MMP25 | Q9NPA2 | 1/20 | 0.39 |
| ▸ | HTR5A | P47898 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | ADRB3 | P13945 | 5/20 | 0.38 |
| ▸ | MMP13 | P45452 | 1/20 | 0.38 |
| ▸ | SNCA | P37840 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1812762 | 1.00 | MMP2 (0.41) | MMP2MMP9MMP1MMP3MMP8 | |
| SCHEMBL1812719 | 0.86 | FFAR1 (0.46) | MMP2MMP9MMP1MMP3MMP8 | |
| SCHEMBL1812720 | 0.86 | FFAR1 (0.46) | MMP2MMP9MMP1MMP3MMP8 | |
| SCHEMBL1810232 | 0.85 | MMP2 (0.47) | MMP2MMP9MMP1MMP3MMP8 | |
| SCHEMBL5498338 | 0.84 | CNR2 (0.44) | MMP2MMP9MMP1MMP3MMP8 | |
| SCHEMBL5498335 | 0.83 | CNR2 (0.45) | MMP2MMP9MMP1MMP3MMP8 | |
| SCHEMBL1813556 | 0.79 | MMP2 (0.45) | MMP2MMP9MMP1MMP3MMP8 | |
| SCHEMBL1814796 | 0.75 | PTGES (0.53) | MMP2MMP9ADRB3 | |
| SCHEMBL1812949 | 0.75 | ACACB (0.49) | MMP2MMP9ADRB3 | |
| Hydrochloric Acid SCHEMBL1817481 | 0.74 | ACACB (0.48) | MMP2MMP9ADRB3 |
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 |
|---|---|---|---|---|---|---|---|
| US-7947851-B2 | 1,1′-(1,2-ethynediyl)bis-benzene derivatives as PTP 1-B inhibitors | MERCK SERONO SA (CH) | 2011-05-24 | — | — | US | disclosed |