Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.43 |
| ▸ | HPGD | P15428 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | DHODH | Q02127 | 2/20 | 0.36 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
| ▸ | JAK3 | P52333 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 3/20 | 0.34 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.34 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.34 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.34 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL6641275 | 0.83 | NLRP3 (0.39) | ALDH1A1KDM4EHPGDMAPTL3MBTL1 | |
| SCHEMBL5662430 | 0.83 | KDM4E (0.46) | ALDH1A1KDM4EHPGDMAPTL3MBTL1 | |
| SCHEMBL2107755 | 0.80 | ALOX5 (0.43) | ALDH1A1KDM4EHPGDMAPTL3MBTL1 | |
| SCHEMBL2108834 | 0.78 | ALDH1A1 (0.39) | ALDH1A1KDM4EHPGDMAPTL3MBTL1 | |
| SCHEMBL2108336 | 0.78 | ALOX5 (0.43) | ALDH1A1KDM4EHPGDMAPTL3MBTL1 | |
| SCHEMBL7722875 | 0.76 | NPC1 (0.41) | ALDH1A1KDM4EHPGDMAPTL3MBTL1 | |
| SCHEMBL17517033 | 0.71 | BRD4 (0.41) | ALDH1A1KDM4EHPGDL3MBTL1HTT | |
| SCHEMBL988060 | 0.71 | TP53 (0.45) | KDM4EMAPTHTTLMNANPC1 | |
| SCHEMBL12666585 | 0.70 | L3MBTL1 (0.52) | ALDH1A1KDM4EMAPTL3MBTL1NLRP3 | |
| SCHEMBL2620013 | 0.69 | ALOX5 (0.48) | ALDH1A1SMN1; SMN2SLC6A3 |
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-6391887-B1 | ANTIINFLAMMATORY AGENTS; AUTOIMMUNE DISEASE; CARDIOVASCULAR DISORDERS | SCHERING AKTIENGESELLSCHAFT (DE) | 2002-05-21 | — | — | US | disclosed |