Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 12/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | CCR1 | P32246 | 1/20 | 0.34 |
| ▸ | CCR5 | P51681 | 1/20 | 0.34 |
| ▸ | CCR8 | P51685 | 1/20 | 0.34 |
| ▸ | PIM1 | P11309 | 1/20 | 0.34 |
| ▸ | BCL2 | P10415 | 1/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 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 | |
|---|---|---|---|---|
| SCHEMBL17348551 | 0.71 | KDM4E (0.38) | KDM4ENPC1RAB9AL3MBTL1BCL2 | |
| SCHEMBL17348546 | 0.71 | KDM4E (0.47) | ERN1KDM4EMEN1NPC1HSP90AA1 | |
| SCHEMBL13313223 | 0.68 | KDM4E (0.47) | KDM4ENPC1RAB9A | |
| SCHEMBL13313257 | 0.68 | ERN1 (0.37) | ERN1KDM4EMEN1IDO1KMT2A | |
| SCHEMBL12766731 | 0.67 | KDM4E (0.38) | ERN1KDM4EMEN1KMT2APIM1 | |
| SCHEMBL13313263 | 0.66 | MMP14 (0.39) | ERN1KDM4EMEN1HSP90AA1IDO1 | |
| SCHEMBL13313253 | 0.66 | MAPT (0.42) | ERN1KDM4EMEN1HSP90AA1IDO1 | |
| SCHEMBL9343167 | 0.65 | KDM4E (0.53) | KDM4EMEN1NPC1HSP90AA1RAB9A | |
| SCHEMBL3234149 | 0.65 | HSP90AA1 (0.53) | KDM4EHSP90AA1PIM1 | |
| SCHEMBL17348572 | 0.64 | KDM4E (0.36) | ERN1KDM4EMEN1NPC1HSP90AA1 |
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-2015191640-A2 | BICYCLIC XANTHINE OXIDASE INHIBITORS AND METHODS OF USE | BAYLOR COLLEGE OF MEDICINE (US) | 2015-12-17 | — | — | WO | disclosed |