Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 15/20 | 0.66 |
| ▸ | ERBB2 | P04626 | 15/20 | 0.66 |
| ▸ | AAK1 | Q2M2I8 | 5/20 | 0.60 |
| ▸ | LCK | P06239 | 2/20 | 0.57 |
| ▸ | KDR | P35968 | 2/20 | 0.57 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.55 |
| ▸ | PRKCG | P05129 | 1/20 | 0.55 |
| ▸ | PRKCB | P05771 | 1/20 | 0.55 |
| ▸ | CDK1 | P06493 | 1/20 | 0.55 |
| ▸ | MET | P08581 | 1/20 | 0.55 |
| ▸ | PRKCA | P17252 | 1/20 | 0.55 |
| ▸ | PRKCH | P24723 | 1/20 | 0.55 |
| ▸ | PRKCI | P41743 | 1/20 | 0.55 |
| ▸ | PRKCE | Q02156 | 1/20 | 0.55 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.55 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.55 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.55 |
| ▸ | PRKD1 | Q15139 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL1219915 | 0.92 | EGFR (0.74) | EGFRERBB2AAK1LCKKDR | |
| Trifluoroacetic Acid SCHEMBL5627012 | 0.90 | EGFR (0.62) | EGFRERBB2AAK1LCKKDR | |
| Trifluoroacetic Acid SCHEMBL5629559 | 0.86 | ERBB2 (0.63) | EGFRERBB2AAK1LCKKDR | |
| Trifluoroacetic Acid SCHEMBL5629155 | 0.84 | EGFR (0.63) | EGFRERBB2AAK1LCKKDR | |
| Trifluoroacetic Acid SCHEMBL5625846 | 0.83 | EGFR (0.84) | EGFRERBB2AAK1LCKKDR | |
| Trifluoroacetic Acid SCHEMBL5625586 | 0.83 | EGFR (0.70) | EGFRERBB2AAK1LCKKDR | |
| SCHEMBL1220037 | 0.81 | EGFR (0.70) | EGFRERBB2AAK1LCKKDR | |
| SCHEMBL1219548 | 0.81 | EGFR (0.78) | EGFRERBB2AAK1LCKKDR | |
| Trifluoroacetic Acid SCHEMBL5626863 | 0.81 | ERBB2 (0.61) | EGFRERBB2AAK1LCKKDR | |
| SCHEMBL1219490 | 0.81 | ERBB2 (1.00) | EGFRERBB2AAK1LCKKDR |
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-7297695-B2 | Pyrrolotriazine compounds as kinase inhibitors | BRISTOL-MYERS SQUIBB COMPANY (US) | 2007-11-20 | — | — | US | disclosed |