Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.32 |
| ▸ | BRAF | P15056 | 1/20 | 0.31 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL572881 | 1.00 | SMYD3 (0.34) | SMYD3KDM4EGAAMAPTHDAC1 | |
| SCHEMBL573095 | 0.81 | MAPT (0.47) | KDM4EGAAMAPT | |
| SCHEMBL573094 | 0.81 | MAPT (0.47) | KDM4EGAAMAPT | |
| SCHEMBL27907103 | 0.79 | ALOX15 (0.33) | SMYD3KDM4EGAAMAPTIRAK4 | |
| SCHEMBL15192577 | 0.78 | ALOX15 (0.38) | SMYD3KDM4EGAAMAPTHDAC1 | |
| SCHEMBL572366 | 0.78 | ALOX15 (0.38) | SMYD3KDM4EGAAMAPTHDAC1 | |
| SCHEMBL27907101 | 0.75 | ALOX15 (0.36) | SMYD3KDM4EGAAMAPTHDAC1 | |
| SCHEMBL572658 | 0.73 | ACACB (0.41) | HDAC1ALOX15 | |
| SCHEMBL572659 | 0.73 | ACACB (0.41) | HDAC1ALOX15 | |
| SCHEMBL2029552 | 0.70 | ALOX15 (0.41) | SMYD3KDM4EGAAMAPTIRAK4 |
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-2611784-A1 | BENZIMIDAZOLE AND AZABENZIMIDAZOLE COMPOUNDS THAT INHIBIT ANAPLASTIC LYMPHOMA KINASE | Amgen, Inc (US) | 2013-07-10 | — | — | EP | disclosed |
| WO-2012018668-A1 | BENZIMIDAZOLE AND AZABENZIMIDAZOLE COMPOUNDS THAT INHIBIT ANAPLASTIC LYMPHOMA KINASE | AMGEN INC. (US) | 2012-02-09 | — | — | WO | disclosed |