Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.33 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CDK4 | P11802 | 6/20 | 0.32 |
| ▸ | CCND3 | P30281 | 6/20 | 0.32 |
| ▸ | CDK6 | Q00534 | 5/20 | 0.32 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.32 |
| ▸ | CCNA2 | P20248 | 4/20 | 0.31 |
| ▸ | CDK2 | P24941 | 4/20 | 0.31 |
| ▸ | CDK1 | P06493 | 3/20 | 0.31 |
| ▸ | CDK7 | P50613 | 3/20 | 0.31 |
| ▸ | CDK9 | P50750 | 3/20 | 0.31 |
| ▸ | CDK5 | Q00535 | 3/20 | 0.31 |
| ▸ | LMNA | P02545 | 3/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.31 |
| ▸ | HSP90B1 | P14625 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL20038551 | 0.83 | CDK4 (0.42) | MEN1NPC1RAB9AKMT2ACDK4 | |
| SCHEMBL20038559 | 0.75 | CDK1 (0.45) | CDK4CDK6CDK2CDK1CDK7 | |
| SCHEMBL20037477 | 0.71 | PDCD1 (0.47) | CDK4CDK6CDK2CDK1CDK7 | |
| SCHEMBL18291526 | 0.70 | CDK4 (0.40) | HRH3CDK4CCND3CDK6CDK2 | |
| SCHEMBL20038383 | 0.70 | LMNA (0.34) | CDK4CCND3CDK6CCNA2CDK2 | |
| SCHEMBL20038618 | 0.69 | CD274 (0.47) | MEN1NPC1RAB9AKMT2ACDK4 | |
| SCHEMBL18291660 | 0.69 | CDK4 (0.44) | CDK4CCND3CDK6CCNA2CDK2 | |
| SCHEMBL20249391 | 0.68 | CDK4 (0.42) | CDK4CCND3CDK6CCNA2CDK2 | |
| SCHEMBL21985979 | 0.68 | CYP2C9 (0.47) | MAPTKCNH2 | |
| SCHEMBL20037475 | 0.68 | KDM4E (0.54) | MEN1KMT2ACDK4CDK6CDK2 |
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-3305785-A1 | PYRIDO[3,4-d]PYRIMIDINE DERIVATIVE AND PHARMACEUTICALLY ACCEPTABLE SALT THEREOF | Teijin Pharma Limited (JP) | 2018-04-11 | — | — | EP | disclosed |