Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 10/20 | 0.41 |
| ▸ | CA2 | P00918 | 10/20 | 0.41 |
| ▸ | CA9 | Q16790 | 8/20 | 0.41 |
| ▸ | CA7 | P43166 | 5/20 | 0.39 |
| ▸ | CA12 | O43570 | 5/20 | 0.39 |
| ▸ | CA4 | P22748 | 3/20 | 0.39 |
| ▸ | CA6 | P23280 | 3/20 | 0.39 |
| ▸ | CA5A | P35218 | 3/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.39 |
| ▸ | CA5B | Q9Y2D0 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | APEX1 | P27695 | 1/20 | 0.34 |
| ▸ | MMP1 | P03956 | 1/20 | 0.33 |
| ▸ | MMP2 | P08253 | 1/20 | 0.33 |
| ▸ | MMP9 | P14780 | 1/20 | 0.33 |
| ▸ | MMP8 | P22894 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2114355 | 0.81 | CA2 (0.62) | CA1CA2CA9CA7CA12 | |
| SCHEMBL709850 | 0.81 | LMNA (0.50) | CA1CA2CA9ALDH1A1 | |
| SCHEMBL18316 | 0.79 | APEX1 (0.50) | CA1CA2CA9CA7CA12 | |
| Hydrochloric Acid SCHEMBL7003118 | 0.77 | APEX1 (0.48) | CA1CA2CA9CA7CA12 | |
| SCHEMBL20280456 | 0.77 | CA1 (0.40) | CA1CA2CA9CA7CA12 | |
| SCHEMBL2111996 | 0.76 | VCAM1 (0.54) | ALDH1A1 | |
| SCHEMBL11427098 | 0.76 | TRPV4 (0.55) | CA1CA2CA9CA7CA12 | |
| SCHEMBL8496857 | 0.74 | CA1 (0.70) | CA1CA2CA9CA7CA12 | |
| SCHEMBL118621 | 0.74 | MAPT (0.45) | CA1CA2CA9CA7CA12 | |
| SCHEMBL242381 | 0.74 | FLT1 (0.46) | CA1CA2CA9CA7CA12 |
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-7632838-B2 | 11-beta HSD1 inhibitors | WYETH (US) | 2009-12-15 | — | — | US | disclosed |