Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 3/20 | 0.48 |
| ▸ | PLK4 | O00444 | 2/20 | 0.48 |
| ▸ | CHEK2 | O96017 | 2/20 | 0.48 |
| ▸ | ABL1 | P00519 | 2/20 | 0.48 |
| ▸ | EGFR | P00533 | 2/20 | 0.48 |
| ▸ | LCK | P06239 | 2/20 | 0.48 |
| ▸ | FYN | P06241 | 2/20 | 0.48 |
| ▸ | CDK1 | P06493 | 2/20 | 0.48 |
| ▸ | RET | P07949 | 2/20 | 0.48 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.48 |
| ▸ | SRC | P12931 | 2/20 | 0.48 |
| ▸ | FGFR3 | P22607 | 2/20 | 0.48 |
| ▸ | RPS6KB1 | P23443 | 2/20 | 0.48 |
| ▸ | MARK3 | P27448 | 2/20 | 0.48 |
| ▸ | KDR | P35968 | 2/20 | 0.48 |
| ▸ | FLT3 | P36888 | 2/20 | 0.48 |
| ▸ | LIMK1 | P53667 | 2/20 | 0.48 |
| ▸ | BTK | Q06187 | 2/20 | 0.48 |
| ▸ | PRKAA1 | Q13131 | 2/20 | 0.48 |
| ▸ | MARK2 | Q7KZI7 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL4779755 | 0.89 | AURKA (0.45) | AURKAPLK4CHEK2ABL1EGFR | |
| SCHEMBL13987722 | 0.89 | AURKA (0.52) | AURKAPLK4CHEK2ABL1EGFR | |
| Acetic Acid SCHEMBL4780974 | 0.87 | AURKA (0.52) | AURKAPLK4CHEK2ABL1EGFR | |
| Acetic Acid SCHEMBL4816025 | 0.87 | AURKA (0.52) | AURKAPLK4CHEK2ABL1EGFR | |
| SCHEMBL4773054 | 0.85 | AURKA (0.46) | AURKAPLK4CHEK2ABL1EGFR | |
| SCHEMBL4772572 | 0.84 | AURKA (0.46) | AURKAPLK4CHEK2ABL1EGFR | |
| SCHEMBL4776881 | 0.84 | AURKA (0.45) | AURKAPLK4CHEK2ABL1EGFR | |
| SCHEMBL4779790 | 0.82 | AURKA (0.53) | AURKAPLK4CHEK2ABL1EGFR | |
| SCHEMBL4779694 | 0.81 | AURKA (0.48) | AURKAPLK4CHEK2ABL1EGFR | |
| SCHEMBL4779430 | 0.81 | AURKA (0.54) | AURKAPLK4CHEK2ABL1EGFR |
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-6967198-B2 | Tricyclic compounds protein kinase inhibitors for enhancing the efficacy of anti-neoplastic agents and radiation therapy | AGOURON PHARMACEUTICALS INC. (US) | 2005-11-22 | — | — | US | disclosed |