Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RYR2 | Q92736 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA4 | P22748 | 1/20 | 0.31 |
| ▸ | CA6 | P23280 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | AURKA | O14965 | 1/20 | 0.31 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.31 |
| ▸ | CDK1 | P06493 | 1/20 | 0.31 |
| ▸ | PIM1 | P11309 | 1/20 | 0.31 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.31 |
| ▸ | CDK2 | P24941 | 1/20 | 0.31 |
| ▸ | MARK3 | P27448 | 1/20 | 0.31 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.31 |
| ▸ | MARK2 | Q7KZI7 | 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 | |
|---|---|---|---|---|
| SCHEMBL20015243 | 0.81 | DRD2 (0.34) | RYR2MEN1ALOX15KMT2ATDP1 | |
| SCHEMBL20123554 | 0.77 | HSD17B3 (0.43) | RYR2TDP1HSD17B3CA1CA2 | |
| SCHEMBL20123676 | 0.77 | HSD17B3 (0.46) | RYR2HSD17B3CA1CA2CA4 | |
| SCHEMBL19939944 | 0.75 | RYR2 (0.32) | RYR2MEN1ALOX15KMT2ATDP1 | |
| SCHEMBL20015049 | 0.73 | RYR2 (0.30) | RYR2 | |
| SCHEMBL21185009 | 0.73 | HDAC9 (0.31) | RYR2MEN1KMT2ATDP1HSD17B3 | |
| SCHEMBL20123579 | 0.71 | HSD17B3 (0.47) | HSD17B3CA1CA2CA4CA6 | |
| SCHEMBL19939720 | 0.71 | ALDH1A1 (0.34) | RYR2TDP1HSD17B3ALDH1A1KDM4E | |
| SCHEMBL3772410 | 0.70 | HSD17B3 (0.43) | RYR2MEN1ALOX15KMT2ATDP1 | |
| SCHEMBL24831713 | 0.70 | MEN1 (0.33) | RYR2MEN1KMT2ATDP1HSD17B3 |
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-2620436-B1 | SUBSTITUTED POLYCYCLIC CARBAMOYL PYRIDONE DERIVATIVE PRODRUG | SHIONOGI & CO (JP) | 2018-05-09 | — | — | EP | disclosed |