Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | KLKB1 | P03952 | 2/20 | 0.39 |
| ▸ | CACNA1G | O43497 | 4/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.34 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.34 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.34 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.34 |
| ▸ | CACNA1I | Q9P0X4 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL754811 | 1.00 | CA12 (0.39) | CA12CA1CA2CA9NPSR1 | |
| SCHEMBL16921568 | 0.79 | NPSR1 (0.43) | CA12CA1CA2CA9NPSR1 | |
| SCHEMBL757223 | 0.79 | NPSR1 (0.43) | CA12CA1CA2CA9NPSR1 | |
| SCHEMBL758898 | 0.76 | NPSR1 (0.42) | NPSR1KLKB1CACNA1GTP53MAPT | |
| SCHEMBL16921562 | 0.76 | PTGIR (0.39) | CA12CA1CA2CA9NPSR1 | |
| SCHEMBL2486131 | 0.75 | KLKB1 (0.49) | NPSR1KLKB1CACNA1GTP53MAPT | |
| SCHEMBL752670 | 0.75 | NPSR1 (0.41) | CA12CA1CA2CA9NPSR1 | |
| SCHEMBL10290773 | 0.75 | NPSR1 (0.41) | CA12CA1CA2CA9NPSR1 | |
| SCHEMBL16921554 | 0.75 | NPSR1 (0.39) | CA12CA1CA2CA9NPSR1 | |
| SCHEMBL756172 | 0.75 | HTT (0.46) | CA12CA1CA2CA9NPSR1 |
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-1422218-B1 | ANTIVIRAL AGENT | SHIONOGI & CO (JP) | 2012-03-21 | — | — | EP | disclosed |