Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP2K1 | Q02750 | 7/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | SRC | P12931 | 9/20 | 0.51 |
| ▸ | ABL1 | P00519 | 3/20 | 0.50 |
| ▸ | BCR | P11274 | 2/20 | 0.50 |
| ▸ | RAF1 | P04049 | 1/20 | 0.49 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | FYN | P06241 | 1/20 | 0.49 |
| ▸ | EGFR | P00533 | 2/20 | 0.48 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.48 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.48 |
| ▸ | FLT1 | P17948 | 1/20 | 0.47 |
| ▸ | KDR | P35968 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL14421313 | 0.86 | MAP2K1 (0.52) | MAP2K1CYP2D6TSHRSRCABL1 | |
| SCHEMBL5027821 | 0.85 | MAP2K1 (0.49) | MAP2K1CYP2D6TSHRSRCABL1 | |
| SCHEMBL5027818 | 0.85 | MAP2K1 (0.49) | MAP2K1CYP2D6TSHRSRCABL1 | |
| SCHEMBL17922753 | 0.85 | MAP2K1 (0.49) | MAP2K1CYP2D6TSHRSRCABL1 | |
| SCHEMBL2163402 | 0.83 | MAP2K1 (0.55) | MAP2K1CYP2D6TSHRSRCABL1 | |
| SCHEMBL3281444 | 0.83 | MAP2K1 (0.55) | MAP2K1CYP2D6TSHRSRCABL1 | |
| Hydrochloric Acid SCHEMBL27950647 | 0.82 | MAP2K1 (0.54) | MAP2K1CYP2D6TSHRSRCABL1 | |
| SCHEMBL14421398 | 0.79 | CYP2D6 (0.56) | MAP2K1CYP2D6TSHRSRCABL1 | |
| SCHEMBL3280339 | 0.79 | CYP2D6 (0.56) | MAP2K1CYP2D6TSHRSRCABL1 | |
| SCHEMBL5023805 | 0.77 | LMNA (0.54) | MAP2K1CYP2D6SRCABL1BCR |
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-1299381-B1 | SUBSTITUTED QUINAZOLINE DERIVATIVES AND THEIR USE AS INHIBITORS | ASTRAZENECA AB (SE) | 2008-05-07 | — | — | EP | disclosed |