Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 10/20 | 0.57 |
| ▸ | HSP90AB1 | P08238 | 7/20 | 0.56 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | RAD52 | P43351 | 1/20 | 0.39 |
| ▸ | AGPAT2 | O15120 | 1/20 | 0.38 |
| ▸ | CDK1 | P06493 | 1/20 | 0.37 |
| ▸ | CDK2 | P24941 | 1/20 | 0.37 |
| ▸ | DHFR | P00374 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL5748835 | 0.83 | HSP90AA1 (0.52) | HSP90AA1HSP90AB1AGPAT2CDK1CDK2 | |
| SCHEMBL5748568 | 0.76 | HSP90AA1 (0.79) | HSP90AA1HSP90AB1MAPTCDK1CDK2 | |
| Hydrochloric Acid SCHEMBL5750130 | 0.74 | HSP90AA1 (0.69) | HSP90AA1HSP90AB1RAD52AGPAT2KDM4E | |
| SCHEMBL3942054 | 0.73 | HSP90AA1 (1.00) | HSP90AA1HSP90AB1DHFRKDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL7077246 | 0.69 | HSP90AA1 (0.55) | HSP90AA1HSP90AB1MAPTKDM4EALDH1A1 | |
| SCHEMBL12940962 | 0.69 | MEN1 (0.49) | MAPTKDM4EALDH1A1 | |
| SCHEMBL11690310 | 0.68 | ALDH1A1 (0.43) | MAPTRAD52KDM4EALDH1A1HTT | |
| SCHEMBL3952648 | 0.68 | HSP90AA1 (0.81) | HSP90AA1HSP90AB1KDM4EALDH1A1 | |
| SCHEMBL17349698 | 0.68 | HSP90AA1 (1.00) | HSP90AA1HSP90AB1AGPAT2 | |
| SCHEMBL3944444 | 0.67 | HSP90AA1 (0.68) | HSP90AA1HSP90AB1AGPAT2 |
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-0901474-B1 | ARYL PYRIMIDINE DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2006-04-19 | — | — | EP | claimed |