Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | CASP3 | P42574 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.31 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.31 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.31 |
| ▸ | PLA2G5 | P39877 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | THRB | P10828 | 1/20 | 0.30 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.30 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.30 |
| ▸ | RELA | Q04206 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL25334933 | 0.82 | BRD4 (0.41) | BRD4 | |
| Hydrochloric Acid SCHEMBL30515108 | 0.81 | BRD4 (0.40) | BRD4 | |
| SCHEMBL1637463 | 0.79 | P2RX7 (0.40) | MAPK1CASP3PLA2G10PLA2G5GAA | |
| SCHEMBL14814407 | 0.79 | P2RX7 (0.40) | MAPK1CASP3PLA2G10PLA2G5GAA | |
| SCHEMBL24750243 | 0.76 | P2RX7 (0.40) | MAPK1CHRM2CHRM1CHRM3 | |
| SCHEMBL23230738 | 0.76 | P2RX7 (0.40) | MAPK1CHRM2CHRM1CHRM3 | |
| SCHEMBL29060344 | 0.74 | MAPK1 (0.30) | MAPK1 | |
| SCHEMBL7393196 | 0.71 | HRH3 (0.33) | MAPK1CASP3 | |
| SCHEMBL6634675 | 0.70 | MAPK1 (0.38) | MAPK1GAAKDM4EMAPTTHRB | |
| SCHEMBL1637995 | 0.69 | P2RX7 (0.40) | MAPK1BRD4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115996927-A | Pyrimido [5,4-d ] pyrimidine derivatives and combinations with adenosine receptor antagonists as ENT inhibitors for the treatment of cancer | ITEOS比利时公司 | 2023-04-21 | — | — | CN | disclosed |