Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | ROCK2 | O75116 | 4/20 | 0.35 |
| ▸ | ROCK1 | Q13464 | 4/20 | 0.35 |
| ▸ | GPR174 | Q9BXC1 | 2/20 | 0.34 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.34 |
| ▸ | HRH2 | P25021 | 1/20 | 0.34 |
| ▸ | HRH1 | P35367 | 1/20 | 0.34 |
| ▸ | MGLL | Q99685 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL15192982 | 0.89 | ALDH1A1 (0.40) | KDM4EMEN1KMT2AHTTALDH1A1 | |
| SCHEMBL572209 | 0.89 | ALDH1A1 (0.40) | KDM4EMEN1KMT2AHTTALDH1A1 | |
| SCHEMBL15192986 | 0.89 | ALDH1A1 (0.40) | KDM4EMEN1KMT2AHTTALDH1A1 | |
| SCHEMBL573186 | 0.89 | NSD2 (0.39) | KDM4EMEN1KMT2AHTTALDH1A1 | |
| SCHEMBL572235 | 0.89 | NSD2 (0.39) | KDM4EMEN1KMT2AHTTALDH1A1 | |
| SCHEMBL573185 | 0.89 | NSD2 (0.39) | KDM4EMEN1KMT2AHTTALDH1A1 | |
| SCHEMBL10270888 | 0.80 | KDM4E (0.43) | KDM4EMEN1KMT2AHTTALDH1A1 | |
| SCHEMBL572765 | 0.80 | KDM4E (0.43) | KDM4EMEN1KMT2AHTTALDH1A1 | |
| SCHEMBL571665 | 0.79 | KDM4E (0.45) | KDM4EMEN1KMT2AHTTALDH1A1 | |
| SCHEMBL10270106 | 0.79 | NSD2 (0.44) | KDM4EMEN1KMT2AHTTALDH1A1 |
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 |