Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 14/20 | 0.63 |
| ▸ | ALK | Q9UM73 | 2/20 | 0.58 |
| ▸ | CDK9 | P50750 | 3/20 | 0.56 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.56 |
| ▸ | AURKA | O14965 | 1/20 | 0.56 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.56 |
| ▸ | JAK2 | O60674 | 1/20 | 0.56 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.56 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.56 |
| ▸ | PAK4 | O96013 | 1/20 | 0.56 |
| ▸ | ABL1 | P00519 | 1/20 | 0.56 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.56 |
| ▸ | LCK | P06239 | 1/20 | 0.56 |
| ▸ | FYN | P06241 | 1/20 | 0.56 |
| ▸ | CSF1R | P07333 | 1/20 | 0.56 |
| ▸ | RET | P07949 | 1/20 | 0.56 |
| ▸ | IGF1R | P08069 | 1/20 | 0.56 |
| ▸ | MET | P08581 | 1/20 | 0.56 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.56 |
| ▸ | PIM1 | P11309 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL12694650 | 0.93 | ALK (0.61) | BRD4ALKCDK9CHEK1AURKA | |
| SCHEMBL12854593 | 0.85 | BRD4 (0.62) | BRD4ALKCDK9CHEK1AURKA | |
| SCHEMBL3112812 | 0.82 | BRD4 (0.61) | BRD4ALKCDK9CHEK1AURKA | |
| SCHEMBL3107379 | 0.82 | BRD4 (0.65) | BRD4ALKCDK9CHEK1AURKA | |
| SCHEMBL12694656 | 0.82 | CTSC (0.61) | BRD4ALKCDK9CHEK1AURKA | |
| SCHEMBL3110197 | 0.81 | BRD4 (0.62) | BRD4ALKCDK9CHEK1AURKA | |
| SCHEMBL3109212 | 0.81 | BRD4 (0.61) | BRD4ALKCDK9CHEK1AURKA | |
| SCHEMBL12694698 | 0.80 | BRD4 (0.53) | BRD4ALKCDK9CHEK1AURKA | |
| SCHEMBL12694654 | 0.79 | BRD4 (0.72) | BRD4ALKCDK9CHEK1AURKA | |
| SCHEMBL12854603 | 0.79 | ALK (0.59) | BRD4ALKCDK9CHEK1AURKA |
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 |
|---|---|---|---|---|---|---|---|
| US-8278299-B2 | Pyrimidinediamine kinase inhibitors | RIGEL PHARMACEUTICALS, INC. (US) | 2012-10-02 | — | — | US | disclosed |