Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | THRB | P10828 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.40 |
| ▸ | HPGD | P15428 | 4/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | CCNA2 | P20248 | 6/20 | 0.39 |
| ▸ | CDK2 | P24941 | 6/20 | 0.39 |
| ▸ | CSNK2B | P67870 | 2/20 | 0.39 |
| ▸ | CSNK2A1 | P68400 | 2/20 | 0.39 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.39 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6164396 | 0.87 | ALDH1A1 (0.41) | ALDH1A1MAPTSMN1; SMN2THRBTDP1 | |
| SCHEMBL6165407 | 0.85 | ALDH1A1 (0.46) | ALDH1A1MAPTSMN1; SMN2THRBTDP1 | |
| SCHEMBL6165127 | 0.83 | ALDH1A1 (0.43) | ALDH1A1MAPTKDM4EHPGDCSNK2B | |
| SCHEMBL6164472 | 0.82 | ALDH1A1 (0.48) | ALDH1A1MAPTSMN1; SMN2THRBTDP1 | |
| SCHEMBL6165077 | 0.82 | CCNA2 (0.45) | ALDH1A1MAPTSMN1; SMN2THRBTDP1 | |
| SCHEMBL6164703 | 0.82 | OPRM1 (0.45) | ALDH1A1MAPTSMN1; SMN2THRBTDP1 | |
| SCHEMBL6167242 | 0.81 | ALDH1A1 (0.62) | ALDH1A1MAPTSMN1; SMN2THRBTDP1 | |
| SCHEMBL6168301 | 0.81 | SMN1; SMN2 (0.43) | ALDH1A1MAPTSMN1; SMN2THRBTDP1 | |
| SCHEMBL7490468 | 0.81 | MEN1 (0.40) | ALDH1A1MAPTSMN1; SMN2THRBTDP1 | |
| SCHEMBL6167327 | 0.80 | ALDH1A1 (0.48) | ALDH1A1MAPTSMN1; SMN2THRBTDP1 |
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 |