Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 2/20 | 0.49 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.46 |
| ▸ | PDGFRA | P16234 | 2/20 | 0.46 |
| ▸ | CDK1 | P06493 | 2/20 | 0.46 |
| ▸ | KDR | P35968 | 2/20 | 0.46 |
| ▸ | CDK2 | P24941 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.45 |
| ▸ | NAMPT | P43490 | 2/20 | 0.45 |
| ▸ | PLAU | P00749 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL1633099 | 0.86 | IKBKB (0.65) | IKBKBCDK1CDK2MAPTCA12 | |
| Hydrochloric Acid SCHEMBL28182076 | 0.85 | PDGFRB (0.58) | PDGFRBPDGFRACDK1KDRCDK2 | |
| SCHEMBL1633690 | 0.82 | IKBKB (0.57) | IKBKBCDK1CDK2CA12CA1 | |
| SCHEMBL1633112 | 0.81 | BRD4 (0.56) | IKBKBCDK1KDRCDK2MAPK1 | |
| SCHEMBL1634724 | 0.79 | IKBKB (0.62) | IKBKBCDK1CDK2CA12CA1 | |
| SCHEMBL1633172 | 0.78 | KDM4E (0.59) | IKBKBCDK2ALDH1A1HTTNPC1 | |
| SCHEMBL3320599 | 0.75 | EGFR (0.76) | PDGFRAKDRMAPTHTTNPC1 | |
| SCHEMBL1571219 | 0.73 | IKBKB (0.48) | IKBKBCDK1CDK2CA12CA1 | |
| SCHEMBL27780313 | 0.73 | IKBKB (0.50) | IKBKBCDK1KDRCDK2CA12 | |
| SCHEMBL8133819 | 0.73 | BRAF (0.41) | IKBKBPDGFRBCDK1KDRCDK2 |
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-6727256-B1 | 4-AMINOQUINAZOLINE DERIVATIVES AS ANTICARCINOGENIC AGENTS | SMITHKLINE BEECHAM CORPORATION | 2004-04-27 | — | — | US | disclosed |