Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 1/20 | 0.73 |
| ▸ | TEK | Q02763 | 1/20 | 0.73 |
| ▸ | EGFR | P00533 | 7/20 | 0.66 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.66 |
| ▸ | EPHB2 | P29323 | 1/20 | 0.66 |
| ▸ | ERBB2 | P04626 | 3/20 | 0.64 |
| ▸ | MAPT | P10636 | 2/20 | 0.58 |
| ▸ | TP53 | P04637 | 1/20 | 0.58 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.58 |
| ▸ | TTBK1 | Q5TCY1 | 2/20 | 0.57 |
| ▸ | TTBK2 | Q6IQ55 | 2/20 | 0.57 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.56 |
| ▸ | GCK | P35557 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.56 |
| ▸ | HTT | P42858 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | USP2 | O75604 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
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 SCHEMBL8808497 | 0.99 | KDR (0.71) | KDRTEKEGFRRIPK2EPHB2 | |
| Hydrochloric Acid SCHEMBL8810268 | 0.90 | KDR (0.70) | KDRTEKEGFRRIPK2EPHB2 | |
| SCHEMBL9017048 | 0.89 | EGFR (0.70) | KDREGFRERBB2MAPK1KDM4E | |
| SCHEMBL7234980 | 0.87 | EGFR (0.77) | KDRTEKEGFRRIPK2EPHB2 | |
| SCHEMBL27878333 | 0.86 | USP2 (0.65) | EGFRMAPTTP53GRM1MEN1 | |
| Hydrochloric Acid SCHEMBL7240600 | 0.86 | EGFR (0.75) | KDRTEKEGFRRIPK2EPHB2 | |
| Hydrochloric Acid SCHEMBL8808415 | 0.86 | KDR (0.71) | KDRTEKEGFRRIPK2EPHB2 | |
| Hydrochloric Acid SCHEMBL8812620 | 0.86 | EGFR (0.76) | KDRTEKEGFRERBB2TTBK1 | |
| SCHEMBL11279693 | 0.85 | MAPT (0.80) | EGFRRIPK2EPHB2ERBB2MAPT | |
| SCHEMBL30017084 | 0.85 | KDR (1.00) | KDRTEKEGFRRIPK2EPHB2 |
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 |