Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | CDK1 | P06493 | 4/20 | 0.40 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.40 |
| ▸ | CDK2 | P24941 | 6/20 | 0.39 |
| ▸ | CCNE1 | P24864 | 5/20 | 0.39 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.39 |
| ▸ | CCNE2 | O96020 | 3/20 | 0.37 |
| ▸ | MAPK14 | Q16539 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 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 | |
|---|---|---|---|---|
| SCHEMBL19111920 | 0.82 | CDK1 (0.46) | NPSR1MAPTTDP1MAPK1MDM2 | |
| SCHEMBL27780397 | 0.78 | NPSR1 (0.47) | NPSR1MAPTTDP1MAPK1MDM2 | |
| SCHEMBL19112453 | 0.77 | NPSR1 (0.60) | NPSR1MAPK1CDK1CDK5CDK2 | |
| SCHEMBL19112171 | 0.77 | NPSR1 (0.60) | NPSR1MAPK1CDK1CDK5CDK2 | |
| SCHEMBL27553389 | 0.71 | MAPK1 (0.47) | NPSR1MAPTTDP1MAPK1MDM2 | |
| SCHEMBL7525338 | 0.71 | HTT (0.67) | NPSR1MAPTTDP1MAPK1MDM2 | |
| SCHEMBL784139 | 0.70 | CDK2 (0.53) | MAPTTDP1MAPK1CDK1CDK5 | |
| SCHEMBL3696799 | 0.69 | CCNA2 (0.51) | NPSR1MAPTTDP1MAPK1MDM2 | |
| SCHEMBL23961642 | 0.68 | TDP1 (0.55) | NPSR1MAPTTDP1MAPK1MDM2 | |
| SCHEMBL19112101 | 0.68 | HTT (0.78) | NPSR1MAPTTDP1MAPK1MDM2 |
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-2664619-B1 | Purine derivatives as tools for screening anti-Alzheimer compounds | MANROS THERAPEUTICS (FR) | 2017-07-12 | — | — | EP | disclosed |