Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.65 |
| ▸ | HSD17B14 | Q9BPX1 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | CES2 | O00748 | 1/20 | 0.52 |
| ▸ | CES1 | P23141 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.50 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 5/20 | 0.49 |
| ▸ | NPC1 | O15118 | 4/20 | 0.49 |
| ▸ | PKM | P14618 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.47 |
| ▸ | RELA | Q04206 | 1/20 | 0.47 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL12441778 | 0.89 | KMT2A (0.56) | KMT2AHSD17B14ALDH1A1CES2CES1 | |
| SCHEMBL12441772 | 0.86 | KMT2A (0.66) | KMT2AHSD17B14ALDH1A1CES2CES1 | |
| SCHEMBL29485021 | 0.84 | KMT2A (0.72) | KMT2AHSD17B14ALDH1A1CES2CES1 | |
| SCHEMBL743166 | 0.84 | KMT2A (0.72) | KMT2AHSD17B14ALDH1A1CES2CES1 | |
| SCHEMBL10349453 | 0.81 | LMNA (0.53) | KMT2AHSD17B14ALDH1A1CES2CES1 | |
| SCHEMBL23388845 | 0.80 | KDM4E (0.68) | KMT2AALDH1A1MEN1LMNAL3MBTL1 | |
| SCHEMBL8503412 | 0.79 | KMT2A (0.56) | KMT2AHSD17B14ALDH1A1CES2CES1 | |
| SCHEMBL398165 | 0.79 | KMT2A (1.00) | KMT2AHSD17B14ALDH1A1CES2CES1 | |
| SCHEMBL29373829 | 0.79 | KMT2A (1.00) | KMT2AHSD17B14ALDH1A1CES2CES1 | |
| SCHEMBL7079612 | 0.79 | KMT2A (0.65) | KMT2AHSD17B14ALDH1A1CES2CES1 |
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-110563641-B | Ortho-halogenated phenyl pyridine ketone compound and preparation method thereof | 三峡大学 | 2023-03-24 | — | — | CN | disclosed |
| CN-110563641-A | Ortho-halogenated phenyl pyridine ketone compound and preparation method thereof | 三峡大学 | 2019-12-13 | — | — | CN | disclosed |