Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 15/20 | 0.68 |
| ▸ | CA12 | O43570 | 2/20 | 0.56 |
| ▸ | CA1 | P00915 | 2/20 | 0.56 |
| ▸ | CA2 | P00918 | 2/20 | 0.56 |
| ▸ | CA9 | Q16790 | 2/20 | 0.56 |
| ▸ | EGFR | P00533 | 2/20 | 0.55 |
| ▸ | PLK1 | P53350 | 1/20 | 0.49 |
| ▸ | IKBKB | O14920 | 1/20 | 0.46 |
| ▸ | FYN | P06241 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL6997904 | 0.85 | FYN (0.61) | KDRPLK1IKBKBFYN | |
| SCHEMBL7238828 | 0.84 | KDR (0.65) | KDRCA12CA1CA2CA9 | |
| SCHEMBL7241137 | 0.82 | KDR (0.72) | KDRCA12CA1CA2CA9 | |
| Hydrochloric Acid SCHEMBL7242637 | 0.80 | FYN (0.59) | KDRPLK1IKBKBFYN | |
| SCHEMBL7237418 | 0.79 | FYN (0.65) | KDRPLK1IKBKBFYN | |
| SCHEMBL7235444 | 0.77 | IKBKB (0.67) | KDRCA12CA1CA2CA9 | |
| Hydrochloric Acid SCHEMBL7516453 | 0.76 | IKBKB (0.66) | KDRCA12CA1CA2CA9 | |
| SCHEMBL7241237 | 0.76 | KDR (0.66) | KDRCA12CA1CA2CA9 | |
| SCHEMBL6998752 | 0.75 | IKBKB (0.58) | KDRCA12CA1CA2CA9 | |
| SCHEMBL6992464 | 0.75 | KDR (0.65) | KDRCA12CA1CA2CA9 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6599908-B1 | Potent and selective inhibitors of the protein tyrosine kinases p56lck and p59fyn | CELLTECH R & D LIMITED (GB) | 2003-07-29 | — | — | US | disclosed |
| US-6057329-A | Fused polycyclic 2-aminopyrimidine derivatives | CELLTECH THERAPEUTICS LIMITED (GB) | 2000-05-02 | — | — | US | disclosed |