Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 4/20 | 0.52 |
| ▸ | CCND1 | P24385 | 4/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.43 |
| ▸ | CCNB2 | O95067 | 2/20 | 0.42 |
| ▸ | CDK1 | P06493 | 2/20 | 0.42 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.42 |
| ▸ | CCNB3 | Q8WWL7 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 5/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | POLB | P06746 | 3/20 | 0.39 |
| ▸ | RECQL | P46063 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2289235 | 1.00 | CDK4 (0.52) | CDK4CCND1ALDH1A1LMNAMAPK1 | |
| SCHEMBL22058627 | 0.80 | TDP1 (0.52) | ALDH1A1LMNAMAPK1MAPTKDM4E | |
| SCHEMBL24063595 | 0.80 | POLB (0.38) | CDK4CCND1ALDH1A1MAPK1MAPT | |
| SCHEMBL25448951 | 0.80 | KDM4E (0.38) | CDK4CCND1ALDH1A1MAPK1MAPT | |
| SCHEMBL20356121 | 0.80 | KDM4E (0.38) | CDK4CCND1ALDH1A1MAPK1MAPT | |
| SCHEMBL9391320 | 0.79 | CDK4 (0.47) | CDK4CCND1ALDH1A1LMNAMAPK1 | |
| SCHEMBL874034 | 0.79 | TDP1 (0.55) | ALDH1A1LMNAMAPK1MAPTKDM4E | |
| SCHEMBL5555577 | 0.78 | CYP2C19 (0.55) | CDK4CCND1ALDH1A1MAPK1MAPT | |
| SCHEMBL5555579 | 0.78 | CYP2C19 (0.55) | CDK4CCND1ALDH1A1MAPK1MAPT | |
| SCHEMBL16476616 | 0.78 | CDK4 (0.70) | CDK4CCND1ALDH1A1LMNAMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021031952-A1 | OXYGEN-SUBSTITUTED SIX-MEMBERED RING PYRIMIDINE COMPOUND, PREPARATION METHOD AND MEDICAL USE THEREOF | 劲方医药科技(上海)有限公司 | 2021-02-25 | — | — | WO | disclosed |
| EP-1804797-B1 | USE OF A PYRIDINE COMPOUND FOR THE PREPARATION OF A MEDICAMENT FOR THE TREATMENT OF SKIN LESIONS | MITSUBISHI TANABE PHARMA CORP (JP) | 2012-04-25 | — | — | EP | disclosed |