Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 4/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.44 |
| ▸ | PHGDH | O43175 | 2/20 | 0.41 |
| ▸ | SIGLEC9 | Q9Y336 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | NOS3 | P29474 | 1/20 | 0.40 |
| ▸ | NOS1 | P29475 | 1/20 | 0.40 |
| ▸ | NOS2 | P35228 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL21590380 | 0.88 | NOS2 (0.40) | ROCK2CYP3A4PHGDHSIGLEC9KDM4E | |
| SCHEMBL21606962 | 0.81 | ALDH1A1 (0.62) | KDM4EMAPT | |
| SCHEMBL4693278 | 0.78 | MAPT (0.51) | KDM4ELMNANPSR1MAPT | |
| SCHEMBL17303596 | 0.78 | GBA1 (0.54) | ROCK2CYP3A4MAPT | |
| SCHEMBL15829881 | 0.77 | MAPT (0.45) | ROCK2CYP3A4MAPT | |
| SCHEMBL5969516 | 0.77 | EPHX2 (0.54) | CYP3A4KDM4ELMNANPSR1 | |
| SCHEMBL3801054 | 0.76 | SPR (0.50) | KDM4EMAPT | |
| SCHEMBL3900029 | 0.75 | ALDH1A1 (0.48) | KDM4EUSP2NPSR1HSD17B10MAPT | |
| SCHEMBL16111210 | 0.75 | OPRM1 (0.60) | NOS3NOS1NOS2OPRM1 | |
| SCHEMBL13860480 | 0.75 | MAPT (0.45) | SIGLEC9KDM4EMAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015086693-A1 | PYRAZOLOPYRIMIDIN-2-YL DERIVATIVES AS JAK INHIBITORS | ALMIRALL, S.A. (ES) | 2015-06-18 | — | — | WO | disclosed |