Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 4/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.48 |
| ▸ | LMNA | P02545 | 4/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.48 |
| ▸ | RELA | Q04206 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28838799 | 0.90 | HDAC6 (0.55) | MEN1KMT2ALMNAALDH1A1KDM4E | |
| SCHEMBL28123453 | 0.88 | LMNA (0.54) | MEN1KMT2ALMNAALDH1A1KDM4E | |
| SCHEMBL28124050 | 0.88 | ALDH1A1 (0.62) | MEN1KMT2ALMNAALDH1A1KDM4E | |
| SCHEMBL28123456 | 0.81 | MAPT (0.61) | MEN1KMT2ALMNAALDH1A1KDM4E | |
| SCHEMBL28838809 | 0.80 | HDAC6 (0.58) | MEN1KMT2ASMN1; SMN2MAPTNPC1 | |
| SCHEMBL29120796 | 0.78 | TRPV4 (0.49) | MEN1KMT2ALMNAALDH1A1KDM4E | |
| SCHEMBL28123442 | 0.78 | HDAC6 (0.58) | MEN1KMT2AMAPTMAPK1HDAC6 | |
| SCHEMBL28124042 | 0.77 | HDAC6 (0.58) | MEN1KMT2AALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL28124048 | 0.77 | HDAC6 (0.60) | MEN1KMT2ALMNAALDH1A1KDM4E | |
| SCHEMBL28123455 | 0.76 | HDAC3 (0.52) | MEN1KMT2ALMNAALDH1A1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-104592116-B | 1,3,5-trisubstituted pyrazole compounds, and preparation method and application thereof | 山东大学 | 2017-01-11 | — | — | CN | claimed |
| CN-104592116-B | 1,3,5-trisubstituted pyrazole compounds, and preparation method and application thereof | 山东大学 | 2017-01-11 | — | — | CN | disclosed |