Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 9/20 | 0.53 |
| ▸ | ERBB2 | P04626 | 3/20 | 0.53 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.52 |
| ▸ | RAF1 | P04049 | 4/20 | 0.51 |
| ▸ | BRAF | P15056 | 4/20 | 0.51 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.50 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.50 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.50 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | GLA | P06280 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.48 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.48 |
| ▸ | LCK | P06239 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL8305842 | 0.89 | EGFR (0.60) | EGFRERBB2GRM4MAPK14MAPK13 | |
| Hydrochloric Acid SCHEMBL8305253 | 0.84 | EGFR (0.64) | EGFRGRM4HTTALKABCG2 | |
| Hydrochloric Acid SCHEMBL8305110 | 0.84 | EGFR (0.51) | EGFRERBB2GRM4MAPK14MAPK13 | |
| SCHEMBL8305099 | 0.84 | EGFR (0.48) | EGFRERBB2RAF1BRAFALK | |
| SCHEMBL8309634 | 0.83 | HDAC3 (0.55) | EGFRERBB2GRM4KDM4ELCK | |
| SCHEMBL8309364 | 0.82 | EGFR (0.70) | EGFRERBB2MAPK14LCK | |
| SCHEMBL8304875 | 0.82 | AURKB (0.69) | EGFRMAPK14 | |
| SCHEMBL5615221 | 0.82 | CD38 (0.48) | EGFRERBB2GRM4MAPK14MAPK13 | |
| SCHEMBL8783016 | 0.82 | GRM4 (0.49) | EGFRERBB2GRM4RAF1BRAF | |
| Hydrochloric Acid SCHEMBL8307571 | 0.82 | EGFR (0.69) | EGFRERBB2MAPK14KDM4ELCK |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0790986-B1 | ANILINE DERIVATIVES | ZENECA LTD (GB) | 1999-01-20 | — | — | EP | disclosed |
| US-5821246-A | USEFUL AS TYROSINE KINASE INHIBITORS AND FOR THE TREATMENT OF PROLIFERATIVE DISEASES SUCH AS CANCER | ZENECA LIMITED (GB) | 1998-10-13 | — | — | US | disclosed |
| EP-0790986-A1 | ANILINE DERIVATIVES | ZENECA LIMITED (GB) | 1997-08-27 | — | — | EP | disclosed |
| WO-1996015118-A1 | ANILINE DERIVATIVES | ZENECA LIMITED (GB) | 1996-05-23 | — | — | WO | disclosed |