Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 8/20 | 0.78 |
| ▸ | FLT1 | P17948 | 4/20 | 0.78 |
| ▸ | FLT4 | P35916 | 4/20 | 0.78 |
| ▸ | CYP2A6 | P11509 | 4/20 | 0.39 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | TDP2 | O95551 | 1/20 | 0.35 |
| ▸ | PRKACA | P17612 | 1/20 | 0.34 |
| ▸ | PRKACG | P22612 | 1/20 | 0.34 |
| ▸ | PRKACB | P22694 | 1/20 | 0.34 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | HTR1D | P28221 | 1/20 | 0.31 |
| ▸ | KRAS | P01116 | 1/20 | 0.31 |
| ▸ | CLK2 | P49760 | 1/20 | 0.31 |
| ▸ | CLK3 | P49761 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7988018 | 0.93 | KDR (0.78) | KDRFLT1FLT4CYP2A6DYRK1A | |
| SCHEMBL7506521 | 0.88 | KDR (0.60) | KDRFLT1FLT4DYRK1AKCNH2 | |
| SCHEMBL7547755 | 0.88 | KDR (1.00) | KDRFLT1FLT4CYP2A6DYRK1A | |
| SCHEMBL7550053 | 0.87 | KDR (0.75) | KDRFLT1FLT4CYP2A6KCNH2 | |
| SCHEMBL7987886 | 0.87 | KDR (0.63) | KDRFLT1FLT4DYRK1AKCNH2 | |
| SCHEMBL7513664 | 0.86 | KDR (0.59) | KDRFLT1FLT4DYRK1AKCNH2 | |
| SCHEMBL7550794 | 0.85 | KDR (0.56) | KDRFLT1FLT4CYP2A6DYRK1A | |
| SCHEMBL7553739 | 0.83 | KDR (0.54) | KDRFLT1FLT4DYRK1AKCNH2 | |
| SCHEMBL7987137 | 0.83 | KDR (0.74) | KDRFLT1FLT4CYP2A6DYRK1A | |
| SCHEMBL7552655 | 0.81 | KDR (0.54) | KDRFLT1FLT4KCNH2PRKACA |
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-6265403-B1 | TYROSINE INHIBITORS | MERCK & CO., INC. | 2001-07-24 | — | — | US | disclosed |