Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | CCNA2 | P20248 | 8/20 | 0.43 |
| ▸ | CDK2 | P24941 | 8/20 | 0.43 |
| ▸ | CCNO | P22674 | 1/20 | 0.38 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.38 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.38 |
| ▸ | DHODH | Q02127 | 1/20 | 0.37 |
| ▸ | CNR1 | P21554 | 3/20 | 0.35 |
| ▸ | CNR2 | P34972 | 3/20 | 0.35 |
| ▸ | BUB1 | O43683 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6164726 | 0.85 | CCNA2 (0.47) | SMN1; SMN2ALDH1A1MAPTTHRBTDP1 | |
| SCHEMBL6164885 | 0.85 | ALDH1A1 (0.58) | SMN1; SMN2ALDH1A1MAPTTHRBTDP1 | |
| SCHEMBL6163901 | 0.84 | SMN1; SMN2 (0.46) | SMN1; SMN2ALDH1A1MAPTTHRBTDP1 | |
| SCHEMBL6164978 | 0.84 | DHODH (0.41) | SMN1; SMN2ALDH1A1CCNA2CDK2DHODH | |
| SCHEMBL6168301 | 0.83 | SMN1; SMN2 (0.43) | SMN1; SMN2ALDH1A1MAPTTHRBTDP1 | |
| SCHEMBL6164260 | 0.83 | ALDH1A1 (0.39) | SMN1; SMN2ALDH1A1MAPTTHRBTDP1 | |
| SCHEMBL6168332 | 0.82 | ALDH1A1 (0.47) | SMN1; SMN2ALDH1A1MAPTTHRBTDP1 | |
| SCHEMBL6163105 | 0.81 | ALDH1A1 (0.43) | SMN1; SMN2ALDH1A1MAPTTHRBTDP1 | |
| SCHEMBL6166346 | 0.79 | CCNA2 (0.39) | SMN1; SMN2ALDH1A1CCNA2CDK2DHODH | |
| SCHEMBL6167327 | 0.78 | ALDH1A1 (0.48) | SMN1; SMN2ALDH1A1MAPTTHRBTDP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1177185-B1 | 4, 5, 6, 7-TETRAHYDROINDAZOLE DERIVATIVES AS ANTITUMOR AGENTS | PHARMACIA ITALIA SPA (IT) | 2005-04-20 | — | — | EP | disclosed |
| US-6716856-B1 | CELL PROLIFERATIVE DISORDERS OR ALZHEIMER'S DISEASE; REDUCED TOXICITY; CDK/CYCLIN KINASE INHIBITORY ACTIVITY | PHARMACIA & TUBJOHN SPA (IT) | 2004-04-06 | — | — | US | disclosed |