Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP2 | P08253 | 11/20 | 0.69 |
| ▸ | MMP1 | P03956 | 8/20 | 0.69 |
| ▸ | MMP9 | P14780 | 8/20 | 0.69 |
| ▸ | MMP13 | P45452 | 8/20 | 0.69 |
| ▸ | MMP3 | P08254 | 7/20 | 0.69 |
| ▸ | MMP7 | P09237 | 7/20 | 0.69 |
| ▸ | MMP14 | P50281 | 1/20 | 0.57 |
| ▸ | CA12 | O43570 | 1/20 | 0.54 |
| ▸ | CA9 | Q16790 | 1/20 | 0.54 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.54 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.53 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.53 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.53 |
| ▸ | CA1 | P00915 | 1/20 | 0.52 |
| ▸ | CA2 | P00918 | 1/20 | 0.52 |
| ▸ | MMP8 | P22894 | 1/20 | 0.52 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL7414131 | 0.85 | MMP2 (0.68) | MMP2MMP1MMP9MMP13MMP3 | |
| SCHEMBL19000605 | 0.84 | TSHR (0.61) | MMP2MMP1MMP9MMP13MMP3 | |
| SCHEMBL13890464 | 0.83 | MMP2 (0.57) | MMP2MMP1MMP9MMP13MMP3 | |
| SCHEMBL7407715 | 0.82 | MMP2 (1.00) | MMP2MMP1MMP9MMP13MMP3 | |
| SCHEMBL7407707 | 0.82 | MMP2 (1.00) | MMP2MMP1MMP9MMP13MMP3 | |
| SCHEMBL14191408 | 0.80 | MMP2 (0.74) | MMP2MMP1MMP9MMP13MMP3 | |
| SCHEMBL3017227 | 0.80 | MMP2 (0.60) | MMP2MMP1MMP9MMP13MMP3 | |
| SCHEMBL8445730 | 0.79 | MMP2 (0.59) | MMP2MMP1MMP9MMP13MMP3 | |
| SCHEMBL1684446 | 0.78 | DHFR (0.67) | MMP2MMP1MMP9MMP13MMP3 | |
| SCHEMBL3412101 | 0.77 | MMP2 (0.58) | MMP2MMP1MMP9MMP13MMP3 |
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-2018011163-A1 | 6,7-DIHYDRO-4H-PYRAZOLO[1,5-A]PYRAZINE AND 6,7-DIHYDRO-4H-TRIAZOLO[1,5-A]PYRAZINE COMPOUNDS FOR THE TREATMENT OF INFECTIOUS DISEASES | F. HOFFMANN-LA ROCHE AG (CH) | 2018-01-18 | — | — | WO | disclosed |