Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 14/20 | 0.69 |
| ▸ | ABCG2 | Q9UNQ0 | 4/20 | 0.69 |
| ▸ | CLK1 | P49759 | 1/20 | 0.69 |
| ▸ | LCK | P06239 | 3/20 | 0.67 |
| ▸ | KDR | P35968 | 6/20 | 0.64 |
| ▸ | JAK3 | P52333 | 2/20 | 0.63 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.63 |
| ▸ | ERBB2 | P04626 | 3/20 | 0.62 |
| ▸ | EPHB2 | P29323 | 3/20 | 0.62 |
| ▸ | GAK | O14976 | 2/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.62 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.62 |
| ▸ | ABL1 | P00519 | 1/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.62 |
| ▸ | CDK1 | P06493 | 1/20 | 0.62 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.62 |
| ▸ | FBP1 | P09467 | 1/20 | 0.62 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.62 |
| ▸ | MAPT | P10636 | 1/20 | 0.62 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.62 |
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 SCHEMBL8810211 | 0.94 | EGFR (0.63) | EGFRABCG2CLK1LCKKDR | |
| Hydrochloric Acid SCHEMBL8808866 | 0.91 | EGFR (0.65) | EGFRABCG2CLK1LCKKDR | |
| Hydrochloric Acid SCHEMBL8812282 | 0.91 | EGFR (0.60) | EGFRABCG2CLK1LCKKDR | |
| Hydrochloric Acid SCHEMBL8816054 | 0.91 | ABCG2 (0.71) | EGFRABCG2CLK1LCKKDR | |
| Hydrochloric Acid SCHEMBL8933913 | 0.88 | EGFR (0.61) | EGFRABCG2CLK1LCKKDR | |
| Hydrochloric Acid SCHEMBL8812010 | 0.85 | EGFR (0.67) | EGFRABCG2CLK1LCKKDR | |
| SCHEMBL1387156 | 0.84 | EGFR (0.75) | EGFRABCG2CLK1LCKKDR | |
| Hydrochloric Acid SCHEMBL8811182 | 0.84 | EGFR (0.76) | EGFRABCG2CLK1LCKKDR | |
| Hydrochloric Acid SCHEMBL8809182 | 0.83 | EGFR (0.67) | EGFRABCG2CLK1LCKKDR | |
| SCHEMBL5570070 | 0.83 | EGFR (0.85) | EGFRABCG2CLK1LCKKDR |
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 |