Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 3/20 | 0.36 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.35 |
| ▸ | CDK9 | P50750 | 1/20 | 0.35 |
| ▸ | TNF | P01375 | 2/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | RPS6KB1 | P23443 | 2/20 | 0.34 |
| ▸ | LDHA | P00338 | 2/20 | 0.34 |
| ▸ | LDHB | P07195 | 2/20 | 0.34 |
| ▸ | EGFR | P00533 | 3/20 | 0.33 |
| ▸ | PRKDC | P78527 | 3/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | ATP1A1 | P05023 | 1/20 | 0.33 |
| ▸ | ATP1B1 | P05026 | 1/20 | 0.33 |
| ▸ | ATP1A3 | P13637 | 1/20 | 0.33 |
| ▸ | ATP1B2 | P14415 | 1/20 | 0.33 |
| ▸ | ATP1A2 | P50993 | 1/20 | 0.33 |
| ▸ | ATP1B3 | P54709 | 1/20 | 0.33 |
| ▸ | FXYD2 | P54710 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Tert-Butyl Formate SCHEMBL27851836 | 0.91 | MAPK1 (0.35) | TNFRPS6KB1PLK1 | |
| Tert-Butyl Formate SCHEMBL27868806 | 0.83 | PDGFRB (0.47) | CDK9TNFPTGS2 | |
| Tert-Butyl Formate SCHEMBL28794442 | 0.82 | LATS1 (0.41) | MAPK14CCNT1CDK9TNFLDHA | |
| Tert-Butyl Formate SCHEMBL27851805 | 0.76 | FYN (0.39) | CCNT1CDK9RPS6KB1 | |
| SCHEMBL781950 | 0.75 | SCD (0.40) | TNFLDHALDHB | |
| Tert-Butyl Formate SCHEMBL27868803 | 0.75 | PIK3CA (0.41) | PTGS2HDAC4HDAC1HDAC6 | |
| Tert-Butyl Formate SCHEMBL27851834 | 0.73 | ROCK2 (0.43) | RPS6KB1 | |
| SCHEMBL28794441 | 0.71 | CCNT1 (0.39) | MAPK14CCNT1CDK9TNFPTGS2 | |
| SCHEMBL780504 | 0.70 | LATS1 (0.47) | MAPK14CCNT1CDK9RPS6KB1LDHA | |
| SCHEMBL20572297 | 0.70 | LATS1 (0.47) | MAPK14CCNT1CDK9RPS6KB1LDHA |
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 |
|---|---|---|---|---|---|---|---|
| CN-102459234-B | Substituted benzotriazines and quinoxalines as P70S6 kinase inhibitors | SENTINEL ONCOLOGY LTD. (GB) | 2014-10-15 | — | — | CN | disclosed |
| CN-102459234-A | Substituted benzotriazines and quinoxalines as P70S6 kinase inhibitors | SENTINEL ONCOLOGY LTD | 2012-05-16 | — | — | CN | disclosed |