Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 1/20 | 0.47 |
| ▸ | CCND1 | P24385 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.41 |
| ▸ | GBA1 | P04062 | 1/20 | 0.41 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.41 |
| ▸ | WNT3A | P56704 | 1/20 | 0.41 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.40 |
| ▸ | CDK2 | P24941 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | BACE1 | P56817 | 2/20 | 0.40 |
| ▸ | KDR | P35968 | 1/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | USP2 | O75604 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3962080 | 0.83 | CDK4 (0.58) | CDK4CCND1MEN1KMT2AGBA1 | |
| SCHEMBL2240341 | 0.83 | CDK4 (0.50) | CDK4CCND1MEN1KMT2AGBA1 | |
| SCHEMBL4776165 | 0.80 | CCKBR (0.52) | CDK4CCND1MEN1KMT2AGBA1 | |
| SCHEMBL2240556 | 0.79 | CYP3A4 (0.41) | CDK4CCND1MEN1KMT2AGBA1 | |
| SCHEMBL4769102 | 0.79 | KMT2A (0.55) | CDK4CCND1MEN1KMT2AGBA1 | |
| SCHEMBL2240652 | 0.78 | CYP1A2 (0.53) | CDK4CCND1MEN1KMT2AGBA1 | |
| SCHEMBL2244808 | 0.78 | SPR (0.59) | CDK4CCND1MEN1KMT2AGBA1 | |
| SCHEMBL4776020 | 0.77 | CDK4 (0.49) | CDK4CCND1MEN1KMT2ASCN9A | |
| SCHEMBL2238410 | 0.77 | CYP1A2 (0.53) | CDK4CCND1MEN1KMT2AGBA1 | |
| SCHEMBL2241460 | 0.76 | CDK4 (0.47) | CDK4CCND1MEN1KMT2AGBA1 |
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-1878733-A1 | Pyrimidine derivatives as ALK-5 inhibitors | Novartis AG (CH) | 2008-01-16 | — | — | EP | disclosed |