Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERBB2 | P04626 | 16/20 | 0.69 |
| ▸ | EGFR | P00533 | 16/20 | 0.69 |
| ▸ | EPHA2 | P29317 | 4/20 | 0.51 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.51 |
| ▸ | MET | P08581 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL4552409 | 1.00 | ERBB2 (0.69) | ERBB2EGFREPHA2EPHB4MET | |
| SCHEMBL1219643 | 0.88 | ERBB2 (0.53) | ERBB2EGFREPHA2EPHB4MET | |
| SCHEMBL12883679 | 0.88 | ERBB2 (0.53) | ERBB2EGFREPHA2EPHB4MET | |
| SCHEMBL2446766 | 0.86 | EGFR (0.70) | ERBB2EGFRMET | |
| SCHEMBL14367954 | 0.82 | ERBB2 (0.50) | ERBB2EGFREPHA2EPHB4MET | |
| SCHEMBL4552654 | 0.82 | EGFR (1.00) | ERBB2EGFRMET | |
| SCHEMBL4552653 | 0.82 | EGFR (1.00) | ERBB2EGFRMET | |
| SCHEMBL6101396 | 0.76 | EGFR (0.78) | ERBB2EGFR | |
| SCHEMBL13709099 | 0.76 | ERBB2 (0.40) | ERBB2EGFREPHA2EPHB4MET | |
| SCHEMBL6097895 | 0.75 | EGFR (0.71) | ERBB2EGFR |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1699798-A4 | DI-SUBSTITUTED PYRROLOTRIAZINE COMPOUNDS | BRISTOL MYERS SQUIBB CO (US) | 2009-03-11 | — | — | EP | disclosed |
| EP-1699798-A2 | DI-SUBSTITUTED PYRROLOTRIAZINE COMPOUNDS | Bristol-Myers Squibb Company (US) | 2006-09-13 | — | — | EP | disclosed |
| US-7064203-B2 | Di-substituted pyrrolotriazine compounds | BRISTOL MYERS SQUIBB COMPANY (US) | 2006-06-20 | — | — | US | disclosed |
| WO-2005065266-A2 | DI-SUBSTITUTED PYRROLOTRIAZINE COMPOUNDS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2005-07-21 | — | — | WO | disclosed |