Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 13/20 | 0.54 |
| ▸ | RET | P07949 | 1/20 | 0.48 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.48 |
| ▸ | EGFR | P00533 | 2/20 | 0.44 |
| ▸ | RAF1 | P04049 | 1/20 | 0.44 |
| ▸ | BRAF | P15056 | 1/20 | 0.44 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.43 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.41 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.40 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.40 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.40 |
| ▸ | CDK1 | P06493 | 1/20 | 0.40 |
| ▸ | CDK4 | P11802 | 1/20 | 0.40 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.40 |
| ▸ | CCND1 | P24385 | 1/20 | 0.40 |
| ▸ | ABL2 | P42684 | 1/20 | 0.40 |
| ▸ | GSK3A | P49840 | 1/20 | 0.40 |
| ▸ | CDK7 | P50613 | 1/20 | 0.40 |
| ▸ | CDK9 | P50750 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5738412 | 0.87 | MAPK14 (0.51) | KDRMAPK14 | |
| SCHEMBL5740421 | 0.87 | KDR (0.52) | KDREGFRMAPK14 | |
| SCHEMBL5740324 | 0.87 | KDR (0.54) | KDREGFRERBB2MAP2K1MAPK14 | |
| SCHEMBL5739893 | 0.86 | KDR (0.71) | KDRRETEGFRERBB2MAP2K1 | |
| SCHEMBL5740240 | 0.86 | KDR (0.53) | KDREGFRRAF1BRAFERBB2 | |
| SCHEMBL5739937 | 0.85 | KDR (0.56) | KDREGFRERBB2MAPK14 | |
| SCHEMBL4051959 | 0.85 | KDR (0.75) | KDRRETLRRK2EGFRERBB2 | |
| SCHEMBL5739216 | 0.84 | KDR (0.55) | KDREGFRERBB2MAP2K1MAPK14 | |
| SCHEMBL5739549 | 0.83 | KDR (0.54) | KDREGFRERBB2MAPK14 | |
| SCHEMBL5739243 | 0.82 | KDR (0.60) | KDREGFRERBB2MAP2K1MAPK14 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1183033-B1 | PYRROLOTRIAZINE INHIBITORS OF KINASES | BRISTOL MYERS SQUIBB CO (US) | 2006-03-01 | — | — | EP | claimed |