Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 3/20 | 0.39 |
| ▸ | CA9 | Q16790 | 3/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | MMP1 | P03956 | 2/20 | 0.37 |
| ▸ | MMP2 | P08253 | 2/20 | 0.37 |
| ▸ | MMP3 | P08254 | 1/20 | 0.37 |
| ▸ | MMP8 | P22894 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CCR6 | P51684 | 1/20 | 0.32 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.32 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | MMP9 | P14780 | 1/20 | 0.31 |
| ▸ | MMP12 | P39900 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL14200293 | 0.83 | ALDH1A1 (0.32) | CA12CA9ALDH1A1ALOX15CHRM1 | |
| SCHEMBL13638256 | 0.78 | CA12 (0.47) | CA12CA9CA1MMP1MMP2 | |
| SCHEMBL11300446 | 0.78 | ALDH1A1 (0.40) | MMP1MMP2MMP3MMP8ALDH1A1 | |
| SCHEMBL8769833 | 0.77 | TSHR (0.51) | CA12CA9CA1MMP1MMP2 | |
| SCHEMBL14229674 | 0.77 | CA12 (0.39) | CA12CA9CA1MMP1MMP2 | |
| SCHEMBL14229154 | 0.75 | CA12 (0.38) | CA12CA9CA1MMP1MMP2 | |
| SCHEMBL4346470 | 0.74 | CA12 (0.50) | CA12CA9CA1MMP1MMP2 | |
| SCHEMBL31011390 | 0.72 | ZDHHC20 (0.41) | CA12CA9CA1MMP1MMP2 | |
| SCHEMBL14230109 | 0.72 | CA12 (0.41) | CA12CA9CA1MMP1MMP2 | |
| SCHEMBL14229504 | 0.72 | CA12 (0.41) | CA12CA9CA1MMP1MMP2 |
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-7365093-B2 | Endothelin antagonists | ABBOTT LABORATORIES (US) | 2008-04-29 | — | — | US | disclosed |