Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | AURKA | O14965 | 1/20 | 0.35 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL20419550 | 0.84 | AURKA (0.37) | KDM4EHTTAURKARPS6KB1SMN1; SMN2 | |
| SCHEMBL20419546 | 0.81 | KDM4E (0.42) | KDM4EALOX15L3MBTL1ALDH1A1RAB9A | |
| SCHEMBL23115927 | 0.75 | AURKA (0.39) | KDM4EAURKARPS6KB1ALDH1A1RAB9A | |
| SCHEMBL1739608 | 0.75 | AURKA (0.42) | KDM4EHTTAURKARPS6KB1SMN1; SMN2 | |
| SCHEMBL9201826 | 0.75 | AURKA (0.56) | KDM4EHTTAURKARPS6KB1ALDH1A1 | |
| SCHEMBL20516624 | 0.74 | KDM4E (0.41) | KDM4EAURKARPS6KB1ALDH1A1RAB9A | |
| SCHEMBL20419551 | 0.73 | AURKA (0.36) | KDM4EHTTAURKARPS6KB1SMN1; SMN2 | |
| SCHEMBL29904890 | 0.73 | AURKA (0.36) | KDM4EHTTAURKARPS6KB1SMN1; SMN2 | |
| SCHEMBL20419549 | 0.73 | AURKA (0.40) | KDM4EL3MBTL1AURKARPS6KB1SMN1; SMN2 | |
| SCHEMBL25111063 | 0.72 | CNR1 (0.50) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018133730-A1 | HETEROCYCLIC COMPOUND, PREPARATION METHOD AND USE THEREFOR | 四川科伦博泰生物医药股份有限公司 | 2018-07-26 | — | — | WO | disclosed |