Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 2/20 | 0.34 |
| ▸ | CCND1 | P24385 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.30 |
| ▸ | GABBR1 | Q9UBS5 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6843076 | 0.90 | GABBR2 (0.32) | CDK4CCND1GABBR2GABBR1 | |
| SCHEMBL1048378 | 0.71 | CDK4 (0.38) | CDK4CCND1ALDH1A1CYP3A4TSHR | |
| SCHEMBL6843112 | 0.70 | ERN1 (0.34) | ALDH1A1TP53CYP3A4TSHRTDP1 | |
| SCHEMBL13763239 | 0.69 | ALDH1A1 (0.45) | CDK4CCND1ALDH1A1CYP3A4TSHR | |
| SCHEMBL7258077 | 0.69 | ALDH1A1 (0.45) | CDK4CCND1ALDH1A1CYP3A4TSHR | |
| SCHEMBL12386784 | 0.67 | ALDH1A1 (0.38) | ALDH1A1TP53CYP3A4TSHRTDP1 | |
| SCHEMBL825288 | 0.67 | ALDH1A1 (0.39) | ALDH1A1TP53CYP3A4TSHRTDP1 | |
| SCHEMBL27963619 | 0.67 | ALDH1A1 (0.39) | ALDH1A1TP53CYP3A4TSHRTDP1 | |
| SCHEMBL6842711 | 0.67 | ERN1 (0.52) | ALDH1A1TP53CYP3A4TSHRTDP1 | |
| SCHEMBL11870495 | 0.67 | ALDH1A1 (0.41) | ALDH1A1TP53CYP3A4TSHRTDP1 |
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-1139990-B1 | AGENT FOR DYING KERATIN FIBERS | HENKEL KGAA (DE) | 2004-05-06 | — | — | EP | claimed |