Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 2/20 | 0.67 |
| ▸ | CCND1 | P24385 | 2/20 | 0.67 |
| ▸ | CDK2 | P24941 | 2/20 | 0.67 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.67 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.67 |
| ▸ | GSK3B | P49841 | 4/20 | 0.60 |
| ▸ | GSK3A | P49840 | 2/20 | 0.60 |
| ▸ | MEN1 | O00255 | 1/20 | 0.60 |
| ▸ | RGS12 | O14924 | 1/20 | 0.60 |
| ▸ | GMNN | O75496 | 1/20 | 0.60 |
| ▸ | USP2 | O75604 | 1/20 | 0.60 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.60 |
| ▸ | LMNA | P02545 | 1/20 | 0.60 |
| ▸ | TP53 | P04637 | 1/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.60 |
| ▸ | CDK1 | P06493 | 1/20 | 0.60 |
| ▸ | POLB | P06746 | 1/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.60 |
| ▸ | MAPT | P10636 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL7987101 | 0.99 | CDK4 (0.66) | CDK4CCND1CDK2CCNE2CCNE1 | |
| SCHEMBL7987757 | 0.92 | CCNE2 (0.66) | CDK4CCND1CDK2CCNE2CCNE1 | |
| SCHEMBL7530443 | 0.90 | GSK3B (0.72) | CDK4CCND1CDK2CCNE2CCNE1 | |
| SCHEMBL7597574 | 0.88 | CCNE2 (0.69) | CDK4CCND1CDK2CCNE2CCNE1 | |
| SCHEMBL7529269 | 0.87 | GSK3B (0.54) | CDK4CCND1CDK2CCNE2CCNE1 | |
| SCHEMBL7524580 | 0.87 | GSK3B (0.58) | CDK4CCND1CDK2CCNE2CCNE1 | |
| SCHEMBL7990678 | 0.85 | GSK3B (0.59) | CDK4CCND1CDK2CCNE2CCNE1 | |
| SCHEMBL7525540 | 0.84 | ALK (0.49) | CDK4CCND1CDK2CCNE2CCNE1 | |
| SCHEMBL7523859 | 0.84 | GSK3B (0.55) | CDK4CCND1CDK2CCNE2CCNE1 | |
| SCHEMBL7988030 | 0.84 | CDK4 (0.45) | CDK4CCND1CDK2CCNE2CCNE1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6281356-B1 | ANTICANRCER AGENTS | HOFFMANN-LA ROCHE INC. | 2001-08-28 | — | — | US | claimed |
| US-6281356-B1 | ANTICANRCER AGENTS | HOFFMANN-LA ROCHE INC. | 2001-08-28 | — | — | US | disclosed |