Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.78 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.71 |
| ▸ | MAPT | P10636 | 1/20 | 0.71 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.71 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.71 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.71 |
| ▸ | CDK2 | P24941 | 14/20 | 0.66 |
| ▸ | CCNE2 | O96020 | 13/20 | 0.66 |
| ▸ | CCNE1 | P24864 | 13/20 | 0.66 |
| ▸ | CDK5 | Q00535 | 4/20 | 0.56 |
| ▸ | CDK1 | P06493 | 4/20 | 0.56 |
| ▸ | CDK5R1 | Q15078 | 2/20 | 0.51 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.51 |
| ▸ | PDE5A | O76074 | 1/20 | 0.51 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.51 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.51 |
| ▸ | CDK7 | P50613 | 1/20 | 0.51 |
| ▸ | CDK9 | P50750 | 1/20 | 0.51 |
| ▸ | CCNH | P51946 | 1/20 | 0.51 |
| ▸ | MNAT1 | P51948 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL19112102 | 0.80 | CDK1 (0.63) | HTTNPSR1MAPTMAPK1MDM2 | |
| SCHEMBL22651961 | 0.77 | NPSR1 (0.70) | HTTNPSR1MAPTMAPK1MDM2 | |
| SCHEMBL19112192 | 0.75 | NPSR1 (0.67) | NPSR1MAPK1CDK2CCNE2CCNE1 | |
| SCHEMBL15387124 | 0.75 | NPSR1 (0.67) | NPSR1MAPK1CDK2CCNE2CCNE1 | |
| SCHEMBL19112178 | 0.75 | NPSR1 (0.67) | NPSR1MAPK1CDK2CCNE2CCNE1 | |
| SCHEMBL30356263 | 0.75 | NPSR1 (0.67) | NPSR1MAPK1CDK2CCNE2CCNE1 | |
| SCHEMBL5828199 | 0.75 | CDK2 (1.00) | HTTCDK2CCNE2CCNE1CDK5 | |
| Hydrochloric Acid SCHEMBL23927315 | 0.74 | NPSR1 (0.66) | NPSR1MAPK1CDK2CCNE2CCNE1 | |
| Hydrochloric Acid SCHEMBL30268945 | 0.74 | NPSR1 (0.66) | NPSR1MAPK1CDK2CCNE2CCNE1 | |
| Hydrochloric Acid SCHEMBL23927317 | 0.74 | NPSR1 (0.66) | NPSR1MAPK1CDK2CCNE2CCNE1 |
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 |