Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.34 |
| ▸ | CA1 | P00915 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | CA7 | P43166 | 2/20 | 0.34 |
| ▸ | CA9 | Q16790 | 2/20 | 0.34 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | CA5A | P35218 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 2/20 | 0.32 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.30 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.30 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL20194127 | 0.83 | S1PR3 (0.38) | ALDH1A1S1PR2S1PR4S1PR3 | |
| SCHEMBL20194126 | 0.83 | SLC6A3 (0.36) | ALDH1A1S1PR3 | |
| SCHEMBL20194121 | 0.78 | F2 (0.46) | ALDH1A1S1PR2S1PR4S1PR3LMNA | |
| SCHEMBL20194125 | 0.74 | GAA (0.41) | CA12CA1CA2CA7CA9 | |
| SCHEMBL20194159 | 0.70 | KDM4E (0.52) | S1PR2S1PR4S1PR3LMNA | |
| SCHEMBL21998506 | 0.69 | ALDH1A1 (0.51) | ALDH1A1GAAS1PR2S1PR4S1PR3 | |
| SCHEMBL30554535 | 0.67 | CA12 (0.73) | CA12CA1CA2CA7CA9 | |
| SCHEMBL1028307 | 0.67 | CA12 (0.73) | CA12CA1CA2CA7CA9 | |
| SCHEMBL30554557 | 0.67 | CA12 (0.73) | CA12CA1CA2CA7CA9 | |
| SCHEMBL6093793 | 0.66 | PARP1 (0.50) | CA12CA1CA2CA7CA9 |
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-3054955-B1 | PYRROLOTRIAZINE KINASE INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2018-05-30 | — | — | EP | disclosed |