Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 3/20 | 0.54 |
| ▸ | AURKB | Q96GD4 | 3/20 | 0.54 |
| ▸ | FLT3 | P36888 | 2/20 | 0.35 |
| ▸ | KDR | P35968 | 2/20 | 0.35 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.35 |
| ▸ | SRC | P12931 | 1/20 | 0.35 |
| ▸ | CDK2 | P24941 | 1/20 | 0.35 |
| ▸ | GSK3B | P49841 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | ERAP1 | Q9NZ08 | 1/20 | 0.34 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
| ▸ | JAK1 | P23458 | 4/20 | 0.33 |
| ▸ | NTRK1 | P04629 | 3/20 | 0.33 |
| ▸ | ACVRL1 | P37023 | 3/20 | 0.33 |
| ▸ | RET | P07949 | 1/20 | 0.33 |
| ▸ | MET | P08581 | 1/20 | 0.33 |
| ▸ | ROS1 | P08922 | 1/20 | 0.33 |
| ▸ | PDE4A | P27815 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL10698085 | 0.80 | AURKA (0.58) | AURKAAURKBFLT3KDRCHEK1 | |
| SCHEMBL10698507 | 0.79 | AURKB (0.59) | AURKAAURKBFLT3KDRCHEK1 | |
| SCHEMBL4957006 | 0.78 | AURKA (0.66) | AURKAAURKBFLT3KDRCHEK1 | |
| SCHEMBL10696602 | 0.77 | AURKA (0.60) | AURKAAURKBFLT3KDRCHEK1 | |
| SCHEMBL5146685 | 0.77 | PDE3B (0.53) | AURKAAURKBFLT3KDRNPC1 | |
| SCHEMBL10698143 | 0.76 | AURKA (0.59) | AURKAAURKBFLT3KDRCHEK1 | |
| SCHEMBL14302115 | 0.75 | IGF1R (0.61) | AURKAAURKBFLT3KDRCHEK1 | |
| SCHEMBL5132799 | 0.75 | IGF1R (0.61) | AURKAAURKBFLT3KDRCHEK1 | |
| SCHEMBL10700370 | 0.75 | AURKA (0.60) | AURKAAURKBFLT3KDRCHEK1 | |
| SCHEMBL10700525 | 0.75 | AURKA (0.61) | AURKAAURKBFLT3KDRCHEK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008022747-A1 | TRICYCLIC LACTAM DERIVATIVES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS | F. HOFFMANN-LA ROCHE AG (CH) | 2008-02-28 | — | — | WO | disclosed |