Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 8/20 | 0.67 |
| ▸ | EPHA2 | P29317 | 7/20 | 0.67 |
| ▸ | ERBB2 | P04626 | 5/20 | 0.67 |
| ▸ | FBP1 | P09467 | 6/20 | 0.64 |
| ▸ | EGFR | P00533 | 10/20 | 0.64 |
| ▸ | CLK1 | P49759 | 2/20 | 0.64 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.64 |
| ▸ | EPHB4 | P54760 | 6/20 | 0.63 |
| ▸ | LCK | P06239 | 2/20 | 0.62 |
| ▸ | GAK | O14976 | 1/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.61 |
| ▸ | MAPT | P10636 | 2/20 | 0.61 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.61 |
| ▸ | SRC | P12931 | 2/20 | 0.61 |
| ▸ | MEN1 | O00255 | 1/20 | 0.61 |
| ▸ | GMNN | O75496 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.61 |
| ▸ | ABL1 | P00519 | 1/20 | 0.61 |
| ▸ | LMNA | P02545 | 1/20 | 0.61 |
| ▸ | RAF1 | P04049 | 1/20 | 0.61 |
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 SCHEMBL8808068 | 0.99 | EPHA2 (0.66) | KDREPHA2ERBB2FBP1EGFR | |
| SCHEMBL8809514 | 0.95 | KDR (0.70) | KDREPHA2ERBB2FBP1EGFR | |
| SCHEMBL8933746 | 0.88 | KDR (0.76) | KDREPHA2ERBB2FBP1EGFR | |
| Hydrochloric Acid SCHEMBL8808204 | 0.87 | ERBB2 (0.75) | KDREPHA2ERBB2FBP1EGFR | |
| Hydrochloric Acid SCHEMBL8811943 | 0.85 | ABCG2 (0.71) | KDREPHA2ERBB2FBP1EGFR | |
| Hydrochloric Acid SCHEMBL8813401 | 0.84 | KDR (0.60) | KDREPHA2ERBB2FBP1EGFR | |
| Hydrochloric Acid SCHEMBL8812010 | 0.83 | EGFR (0.67) | KDRERBB2FBP1EGFRCLK1 | |
| SCHEMBL8807745 | 0.83 | KDR (0.80) | KDREPHA2ERBB2FBP1EGFR | |
| SCHEMBL22336753 | 0.82 | FBP1 (0.92) | KDRERBB2FBP1EGFRCLK1 | |
| Hydrochloric Acid SCHEMBL8807802 | 0.81 | FBP1 (0.63) | KDREPHA2ERBB2FBP1EGFR |
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 |
|---|---|---|---|---|---|---|---|
| WO-1996009294-A1 | SUBSTITUTED HETEROAROMATIC COMPOUNDS AND THEIR USE IN MEDICINE | THE WELLCOME FOUNDATION LIMITED (GB) | 1996-03-28 | — | — | WO | disclosed |