Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.53 |
| ▸ | CA2 | P00918 | 2/20 | 0.53 |
| ▸ | CA7 | P43166 | 2/20 | 0.53 |
| ▸ | CTSK | P43235 | 11/20 | 0.45 |
| ▸ | CTSS | P25774 | 5/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | CA4 | P22748 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8437509 | 0.95 | CA1 (0.51) | CA1CA2CA7CTSKCTSS | |
| SCHEMBL12880709 | 0.84 | CA1 (0.51) | CA1CA2CA7CTSKCTSS | |
| SCHEMBL6546238 | 0.84 | CA2 (0.56) | CA1CA2CA7CTSKCTSS | |
| SCHEMBL7295817 | 0.84 | CA2 (0.56) | CA1CA2CA7CTSKCTSS | |
| SCHEMBL7295814 | 0.84 | CA2 (0.56) | CA1CA2CA7CTSKCTSS | |
| SCHEMBL31526477 | 0.83 | CA1 (0.47) | CA1CA2CA7CTSKCTSS | |
| SCHEMBL24257249 | 0.83 | CA1 (0.41) | CA1CA2CA7CTSKCTSS | |
| SCHEMBL6690527 | 0.83 | CA1 (0.50) | CA1CA2CA7CTSKCTSS | |
| SCHEMBL1809665 | 0.81 | CA1 (0.71) | CA1CA2CA7CTSKCTSS | |
| SCHEMBL1134642 | 0.81 | CA1 (0.71) | CA1CA2CA7CTSKCTSS |
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 |
|---|---|---|---|---|---|---|---|
| EP-3408268-B1 | BENZIMIDAZOLE DERIVATIVES AS MODULATORS OF ROR-GAMMA | VITAE PHARMACEUTICALS LLC (US) | 2021-08-04 | — | — | EP | disclosed |