Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 2/20 | 0.49 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.44 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.42 |
| ▸ | RAB9A | P51151 | 4/20 | 0.42 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | HTT | P42858 | 3/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | NPY1R | P25929 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | LTA4H | P09960 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8479012 | 0.91 | ESRRG (0.39) | EGFRITGB3ITGA2BALDH1A1KDM4E | |
| SCHEMBL8537606 | 0.80 | L3MBTL1 (0.56) | ALDH1A1KDM4ERAB9ANPC1HTT | |
| SCHEMBL8478346 | 0.79 | KDM1A (0.41) | EGFRALDH1A1L3MBTL1SMN1; SMN2POLB | |
| SCHEMBL8477764 | 0.79 | MAPT (0.41) | EGFRALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL8478646 | 0.79 | MAPT (0.39) | EGFRALDH1A1L3MBTL1SMN1; SMN2MAPT | |
| SCHEMBL8478625 | 0.79 | EGFR (0.45) | EGFRITGB3ITGA2BALDH1A1KDM4E | |
| SCHEMBL8482595 | 0.78 | S1PR1 (0.37) | EGFRITGB3ITGA2BALDH1A1SMN1; SMN2 | |
| SCHEMBL8482399 | 0.78 | KDM4E (0.41) | ALDH1A1KDM4EL3MBTL1POLBMAPT | |
| SCHEMBL8478317 | 0.78 | ITGB3 (0.41) | EGFRITGB3ITGA2BALDH1A1L3MBTL1 | |
| SCHEMBL7265773 | 0.76 | EGFR (0.45) | EGFRALDH1A1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-5871709-A | TETRAAZACYCLODODECANE COMPOUNDS SUBSTITUTED WITH ALKYL CARBOXY COMPOUNDS FOR CARDIOVASCULAR DISORDERS AND BRAIN TUMORS | SCHERING AKTIENGESELLSCHAFT (DE) | 1999-02-16 | — | — | US | disclosed |