Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 12/20 | 0.70 |
| ▸ | EGFR | P00533 | 2/20 | 0.55 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.54 |
| ▸ | MAPK14 | Q16539 | 6/20 | 0.51 |
| ▸ | ERBB2 | P04626 | 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 | |
|---|---|---|---|---|
| SCHEMBL5517509 | 0.90 | KDR (0.85) | KDREGFRMAP2K1MAPK14ERBB2 | |
| SCHEMBL5516114 | 0.86 | KDR (0.80) | KDREGFR | |
| SCHEMBL14451943 | 0.82 | KDR (0.61) | KDREGFRMAP2K1MAPK14ERBB2 | |
| SCHEMBL4046874 | 0.82 | KDR (1.00) | KDREGFRMAP2K1MAPK14 | |
| SCHEMBL5511157 | 0.81 | KDR (0.84) | KDREGFRMAP2K1MAPK14 | |
| SCHEMBL5740556 | 0.81 | KDR (0.62) | KDREGFRMAP2K1MAPK14 | |
| SCHEMBL27576856 | 0.81 | KDR (0.59) | KDREGFRMAP2K1MAPK14 | |
| SCHEMBL16800773 | 0.81 | EGFR (0.66) | KDREGFRMAP2K1MAPK14ERBB2 | |
| SCHEMBL7583147 | 0.81 | MAPK14 (0.58) | KDREGFRMAPK14 | |
| SCHEMBL7536628 | 0.80 | KDR (0.68) | KDREGFRMAP2K1MAPK14ERBB2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1183033-A4 | PYRROLOTRIAZINE INHIBITORS OF KINASES | BRISTOL MYERS SQUIBB CO (US) | 2002-07-17 | — | — | EP | disclosed |
| EP-1183033-A1 | PYRROLOTRIAZINE INHIBITORS OF KINASES | BRISTOL-MYERS SQUIBB COMPANY (US) | 2002-03-06 | — | — | EP | disclosed |
| WO-2000071129-A1 | PYRROLOTRIAZINE INHIBITORS OF KINASES | BRISTOL-MYERS SQUIBB COMPANY (US) | 2000-11-30 | — | — | WO | disclosed |