Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 7/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | FAAH | O00519 | 1/20 | 0.41 |
| ▸ | MGLL | Q99685 | 1/20 | 0.41 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.41 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.41 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.41 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.41 |
| ▸ | PPARG | P37231 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28666647 | 0.88 | ABCG2 (0.45) | ABCG2NPC1KDM4EALDH1A1CYP19A1 | |
| SCHEMBL22499952 | 0.86 | ABCG2 (0.45) | ABCG2NPC1L3MBTL1ATMKDM4E | |
| SCHEMBL10769734 | 0.78 | ABCG2 (0.72) | ABCG2NPC1L3MBTL1ATMKDM4E | |
| SCHEMBL28659825 | 0.77 | ALDH1A1 (0.43) | ABCG2NPC1KDM4EALDH1A1CYP19A1 | |
| SCHEMBL15935630 | 0.75 | NPC1 (0.45) | NPC1L3MBTL1ALDH1A1PKMRAB9A | |
| SCHEMBL29385131 | 0.73 | MAOB (0.41) | NPC1L3MBTL1KDM4EALDH1A1CYP19A1 | |
| SCHEMBL15935708 | 0.73 | NPC1 (0.43) | NPC1L3MBTL1PKMRAB9ASMN1; SMN2 | |
| SCHEMBL28565701 | 0.72 | ABCG2 (0.69) | ABCG2NPC1L3MBTL1ATMKDM4E | |
| SCHEMBL28665391 | 0.70 | MEN1 (0.42) | NPC1L3MBTL1KDM4EALDH1A1CYP19A1 | |
| SCHEMBL17523228 | 0.68 | ABCG2 (0.58) | ABCG2NPC1KDM4EALDH1A1RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| CN-113825398-A | Pyridazinone compounds and herbicides | 日产化学株式会社 | 2021-12-21 | — | — | CN | disclosed |