Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP3K5 | Q99683 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | CTSD | P07339 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 4/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.42 |
| ▸ | EGFR | P00533 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | FDPS | P14324 | 1/20 | 0.41 |
| ▸ | PCSK9 | Q8NBP7 | 1/20 | 0.41 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.41 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.41 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.41 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | GPR3 | P46089 | 1/20 | 0.38 |
| ▸ | IGF1R | P08069 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL27770482 | 0.83 | MAP3K5 (0.60) | MAP3K5RAB9ASMN1; SMN2NPC1MAPK1 | |
| Benzene SCHEMBL28188863 | 0.83 | MAP3K5 (0.60) | MAP3K5RAB9ASMN1; SMN2NPC1MAPK1 | |
| SCHEMBL31381352 | 0.83 | MAP3K5 (0.60) | MAP3K5RAB9ASMN1; SMN2NPC1MAPK1 | |
| SCHEMBL167891 | 0.83 | MAP3K5 (0.60) | MAP3K5RAB9ASMN1; SMN2NPC1MAPK1 | |
| SCHEMBL4573935 | 0.81 | MAP3K5 (0.58) | MAP3K5RAB9ASMN1; SMN2NPC1MAPK1 | |
| Hydrochloric Acid SCHEMBL8807679 | 0.81 | MAP3K5 (0.58) | MAP3K5RAB9ASMN1; SMN2NPC1MAPK1 | |
| SCHEMBL6467426 | 0.78 | MAP3K5 (0.54) | MAP3K5ALDH1A1SMN1; SMN2EGFRMAPT | |
| SCHEMBL2267481 | 0.77 | FDPS (0.48) | MAP3K5ALDH1A1RAB9ASMN1; SMN2EGFR | |
| Quinoline SCHEMBL28107595 | 0.75 | ALDH1A1 (0.53) | MAP3K5ALDH1A1RAB9ASMN1; SMN2EGFR | |
| SCHEMBL2338189 | 0.75 | MAPT (0.46) | MAP3K5ALDH1A1EGFRMAPTFDPS |
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-1957468-A2 | POLYALKYLENE GLYCOL DERIVATIVES OF 4 - (PHENYLAMINO)QUINAZOLINES USEFUL AS IRREVERSIBLE INHIBITORS OF EPIDERMAL GROWTH FACTOR RECEPTOR TYROSINE KINASE | T.K. Signal Ltd. (IL) | 2008-08-20 | — | — | EP | disclosed |
| WO-2007029251-A2 | POLYALKYLENE GLYCOL DERIVATIVES OF 4- (PHENYLAMINO)QUINAZOLINES USEFUL AS IRREVERSIBLE INHIBITORS OF EPIDERMAL GR0WTH FACT0R RECEPTOR TYROSINE KINASE | T.K. SIGNAL LTD. (IL) | 2007-03-15 | — | — | WO | disclosed |