Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PRKDC | P78527 | 1/20 | 0.41 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.41 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.41 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.41 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.41 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.41 |
| ▸ | CHRNB3 | Q05901 | 1/20 | 0.41 |
| ▸ | USP1 | O94782 | 1/20 | 0.40 |
| ▸ | WDR48 | Q8TAF3 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 7/20 | 0.40 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.40 |
| ▸ | ELANE | P08246 | 1/20 | 0.39 |
| ▸ | SMO | Q99835 | 1/20 | 0.38 |
| ▸ | PIK3CA | P42336 | 3/20 | 0.37 |
| ▸ | MTOR | P42345 | 3/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL15859901 | 0.83 | CDK1 (0.45) | CHRNB1CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL24632524 | 0.78 | AKT2 (0.44) | CHRNB2CHRNA4USP1WDR48HRH3 | |
| SCHEMBL31625156 | 0.78 | AKT2 (0.44) | CHRNB2CHRNA4USP1WDR48HRH3 | |
| SCHEMBL28263429 | 0.78 | HRH3 (0.48) | HRH3 | |
| SCHEMBL12595589 | 0.78 | PIK3CA (0.51) | CHRNB2CHRNA4USP1WDR48HRH3 | |
| SCHEMBL17297771 | 0.77 | USP1 (0.47) | CHRNB1CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL21180884 | 0.76 | MAPT (0.62) | — | |
| SCHEMBL17664587 | 0.76 | MAPT (0.49) | CHRNB1CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL17297906 | 0.76 | USP2 (0.49) | CHRNB1CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL24681513 | 0.76 | USP1 (0.42) | CHRNB1CHRNB2CHRNB4CHRNA3CHRNA4 |
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 |