Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM4 | Q14833 | 4/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.56 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | HSD17B14 | Q9BPX1 | 1/20 | 0.48 |
| ▸ | AGTR1 | P30556 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | PKM | P14618 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | PTGS1 | P23219 | 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 | |
|---|---|---|---|---|
| SCHEMBL28335130 | 0.84 | KMT2A (0.63) | GRM4ALDH1A1L3MBTL1KMT2AAGTR1 | |
| SCHEMBL28337424 | 0.82 | RAB9A (0.53) | GRM4ALDH1A1L3MBTL1KMT2AMEN1 | |
| SCHEMBL8305769 | 0.82 | RAB9A (0.49) | GRM4ALDH1A1L3MBTL1KMT2AMEN1 | |
| SCHEMBL28335316 | 0.82 | HSD17B14 (0.48) | GRM4ALDH1A1L3MBTL1ALOX15NPSR1 | |
| SCHEMBL17842156 | 0.80 | GRM4 (0.64) | GRM4ALDH1A1L3MBTL1KMT2AMEN1 | |
| SCHEMBL6122369 | 0.80 | KEAP1 (0.53) | GRM4ALDH1A1L3MBTL1ALOX15NPSR1 | |
| SCHEMBL5655050 | 0.79 | GRM4 (0.50) | GRM4ALDH1A1L3MBTL1ALOX15NPSR1 | |
| SCHEMBL2861947 | 0.78 | HPGD (0.61) | ALDH1A1ALOX15KMT2ANPC1PKM | |
| SCHEMBL8307409 | 0.77 | NPC1 (0.66) | ALDH1A1NPSR1KMT2AMEN1NPC1 | |
| SCHEMBL8709883 | 0.77 | HSD17B14 (0.56) | GRM4ALDH1A1L3MBTL1ALOX15NPSR1 |
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 |