Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NTRK1 | P04629 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.39 |
| ▸ | MET | P08581 | 1/20 | 0.37 |
| ▸ | PIM1 | P11309 | 1/20 | 0.37 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.37 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.37 |
| ▸ | FLT3 | P36888 | 1/20 | 0.37 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
| ▸ | NTRK3 | Q16288 | 1/20 | 0.37 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.37 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.37 |
| ▸ | GPR119 | Q8TDV5 | 3/20 | 0.37 |
| ▸ | SYK | P43405 | 1/20 | 0.37 |
| ▸ | MGLL | Q99685 | 1/20 | 0.37 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5036088 | 0.92 | CA12 (0.42) | KDM4EHTTKMT2AMAPK1 | |
| SCHEMBL5032572 | 0.91 | KIF18A (0.45) | KDM4EHTTKMT2AMAPK1EPHX2 | |
| SCHEMBL5036557 | 0.91 | KMT2A (0.41) | NTRK1KDM4EHTTKMT2AMAPK1 | |
| SCHEMBL5032665 | 0.89 | KIF18A (0.46) | KDM4EHTTKMT2AMAPK1RORC | |
| SCHEMBL5035013 | 0.88 | KDM4E (0.46) | NTRK1KDM4EHTTKMT2AMAPK1 | |
| SCHEMBL5032666 | 0.88 | NTRK1 (0.44) | NTRK1KDM4EHTTKMT2AMAPK1 | |
| SCHEMBL5041069 | 0.87 | MAPK1 (0.49) | NTRK1KDM4EHTTKMT2AMAPK1 | |
| SCHEMBL5039150 | 0.86 | KDM4E (0.54) | NTRK1KDM4EHTTKMT2AMAPK1 | |
| SCHEMBL5039328 | 0.83 | CA2 (0.46) | KDM4EHTTKMT2AMAPK1MAPT | |
| SCHEMBL5041442 | 0.83 | KDM4E (0.45) | KDM4EHTTKMT2AMAPK1RXFP1 |
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-1761541-B1 | PYRRAZOLO-PYRIMIDINE DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2008-01-09 | — | — | EP | claimed |