Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B2 | P19099 | 1/20 | 0.48 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.43 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | METAP2 | P50579 | 1/20 | 0.36 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.36 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.35 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.35 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL20413782 | 0.85 | ALDH1A1 (0.47) | GRM1CYP1A2CYP17A1ALDH1A1NPC1 | |
| SCHEMBL15839181 | 0.84 | CYP11B2 (0.48) | CYP11B2GRM1CYP2A6CYP1A2CYP17A1 | |
| SCHEMBL6276508 | 0.80 | NPC1 (0.46) | GRM1ALDH1A1NPC1RAB9AKMT2A | |
| SCHEMBL6278822 | 0.78 | RXFP1 (0.45) | CYP11B2CYP1A2CYP17A1GSK3BNPC1 | |
| SCHEMBL15839017 | 0.76 | CYP11B2 (0.49) | CYP11B2GRM1CYP2A6CYP1A2CYP17A1 | |
| SCHEMBL15839068 | 0.75 | CYP11B2 (0.55) | CYP11B2GRM1CYP2A6CYP1A2CYP17A1 | |
| SCHEMBL6282717 | 0.73 | GSK3B (0.44) | CYP11B2GSK3BCYP3A4SCN9A | |
| SCHEMBL6225827 | 0.73 | NPBWR1 (0.39) | CYP11B2NPC1RAB9AMAPTPAX8 | |
| SCHEMBL15839010 | 0.72 | CYP11B2 (0.56) | CYP11B2CYP1A2CYP17A1CYP3A4METAP2 | |
| SCHEMBL15839015 | 0.72 | CYP11B2 (0.58) | CYP11B2GRM1CYP2A6CYP1A2CYP17A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1523314-A2 | PYRAZOLOPYRIMIDINES AS PROTEIN KINASE INHIBITORS | SmithKline Beecham Corporation (US) | 2005-04-20 | — | — | EP | disclosed |
| WO-2004009597-A2 | PYRAZOLOPYRIMIDINES AS PROTEIN KINASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2004-01-29 | — | — | WO | disclosed |