Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | GSK3B | P49841 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 6/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.40 |
| ▸ | MEN1 | O00255 | 4/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | CLK1 | P49759 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL13308747 | 0.90 | KDM4E (0.44) | KDM4EALDH1A1TP53POLBGSK3B | |
| SCHEMBL13309052 | 0.88 | KDM4E (0.43) | KDM4EALDH1A1TP53POLBGSK3B | |
| SCHEMBL13309241 | 0.85 | GSK3B (0.46) | KDM4EALDH1A1TP53POLBGSK3B | |
| SCHEMBL13309179 | 0.82 | GSK3B (0.48) | KDM4EALDH1A1TP53POLBGSK3B | |
| SCHEMBL14528898 | 0.82 | KDM4E (0.41) | KDM4EALDH1A1TP53POLBGSK3B | |
| SCHEMBL13885070 | 0.81 | GSK3B (0.60) | KDM4EALDH1A1TP53POLBGSK3B | |
| SCHEMBL13309102 | 0.81 | CA12 (0.45) | KDM4EALDH1A1TP53POLBGSK3B | |
| SCHEMBL14528759 | 0.80 | IKBKB (0.42) | KDM4ETP53POLBGSK3BMAPT | |
| SCHEMBL13309058 | 0.79 | MEN1 (0.43) | KDM4EALDH1A1TP53POLBGSK3B | |
| SCHEMBL14529038 | 0.79 | KDM4E (0.46) | KDM4EALDH1A1TP53POLBGSK3B |
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-1934224-B1 | PYRAZOLOPYRIMIDINES AS CYCLIN DEPENDENT KINASE INHIBITORS FOR THE TREATMENT OF CANCER | SCHERING CORP (US) | 2010-06-09 | — | — | EP | disclosed |