Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 9/20 | 0.56 |
| ▸ | GAK | O14976 | 1/20 | 0.56 |
| ▸ | EPHA2 | P29317 | 8/20 | 0.54 |
| ▸ | EPHB4 | P54760 | 7/20 | 0.54 |
| ▸ | ERBB2 | P04626 | 6/20 | 0.54 |
| ▸ | KDR | P35968 | 10/20 | 0.53 |
| ▸ | PDGFRB | P09619 | 3/20 | 0.53 |
| ▸ | ABL1 | P00519 | 2/20 | 0.53 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.53 |
| ▸ | SRC | P12931 | 2/20 | 0.53 |
| ▸ | AURKA | O14965 | 1/20 | 0.51 |
| ▸ | INSR | P06213 | 1/20 | 0.51 |
| ▸ | FBP1 | P09467 | 1/20 | 0.51 |
| ▸ | FLT4 | P35916 | 1/20 | 0.51 |
| ▸ | CLK1 | P49759 | 1/20 | 0.51 |
| ▸ | TEK | Q02763 | 1/20 | 0.51 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8809559 | 0.88 | EGFR (0.68) | EGFRGAKEPHA2EPHB4ERBB2 | |
| Hydrochloric Acid SCHEMBL8810147 | 0.84 | ABCG2 (0.65) | EGFRGAKEPHA2EPHB4ERBB2 | |
| Hydrochloric Acid SCHEMBL8807802 | 0.84 | FBP1 (0.63) | EGFRGAKEPHA2EPHB4ERBB2 | |
| Hydrochloric Acid SCHEMBL8811245 | 0.83 | EGFR (0.64) | EGFRGAKEPHA2EPHB4ERBB2 | |
| Hydrochloric Acid SCHEMBL8815584 | 0.79 | EGFR (0.70) | EGFRGAKEPHA2EPHB4ERBB2 | |
| Hydrochloric Acid SCHEMBL8808866 | 0.79 | EGFR (0.65) | EGFRGAKEPHA2EPHB4ERBB2 | |
| SCHEMBL7890179 | 0.78 | EGFR (0.55) | EGFRGAKEPHA2EPHB4ERBB2 | |
| SCHEMBL8933754 | 0.77 | EGFR (0.80) | EGFRGAKEPHA2EPHB4ERBB2 | |
| Hydrochloric Acid SCHEMBL7888563 | 0.77 | EGFR (0.55) | EGFRGAKEPHA2EPHB4ERBB2 | |
| Hydrochloric Acid SCHEMBL8810665 | 0.77 | EGFR (0.79) | EGFRGAKEPHA2EPHB4ERBB2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0782570-A1 | SUBSTITUTED HETEROAROMATIC COMPOUNDS AND THEIR USE IN MEDICINE | THE WELLCOME FOUNDATION LIMITED (GB) | 1997-07-09 | — | — | EP | disclosed |
| WO-1996009294-A1 | SUBSTITUTED HETEROAROMATIC COMPOUNDS AND THEIR USE IN MEDICINE | THE WELLCOME FOUNDATION LIMITED (GB) | 1996-03-28 | — | — | WO | disclosed |