Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | RAD52 | P43351 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SMYD3 | Q9H7B4 | 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 | |
|---|---|---|---|---|
| SCHEMBL20614282 | 0.80 | RAD52 (0.58) | CYP1A2TSHRTP53CYP3A4CYP2D6 | |
| SCHEMBL7947655 | 0.80 | RAD52 (0.58) | CYP1A2TSHRTP53CYP3A4CYP2D6 | |
| SCHEMBL8151269 | 0.79 | RAD52 (0.42) | CYP1A2TSHRTP53CYP3A4CYP2D6 | |
| SCHEMBL477251 | 0.79 | DRD4 (0.40) | SMN1; SMN2SMYD3 | |
| SCHEMBL6973435 | 0.78 | RAD52 (0.55) | CYP1A2TSHRTP53CYP3A4CYP2D6 | |
| SCHEMBL6435144 | 0.78 | DRD4 (0.40) | SMN1; SMN2EPHX1SMYD3 | |
| SCHEMBL6414021 | 0.76 | EPHX2 (0.50) | EPHX1MEN1KMT2A | |
| SCHEMBL28813230 | 0.76 | EPHX1 (0.41) | SMN1; SMN2EPHX1MEN1KMT2A | |
| SCHEMBL2225265 | 0.75 | KDM4E (0.40) | SMN1; SMN2LMNA | |
| SCHEMBL6493217 | 0.75 | RAD52 (0.59) | SMN1; SMN2RAD52LMNAEPHX1GAA |
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 |