Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | CA4 | P22748 | 1/20 | 0.48 |
| ▸ | ACP3 | P15309 | 1/20 | 0.47 |
| ▸ | LTA4H | P09960 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | CES2 | O00748 | 1/20 | 0.44 |
| ▸ | CES1 | P23141 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL31472733 | 0.98 | PKM (0.54) | PKMHTTHPGDCA4ACP3 | |
| SCHEMBL332078 | 0.85 | L3MBTL1 (0.58) | PKMHTTCA4ALDH1A1L3MBTL1 | |
| SCHEMBL28702159 | 0.85 | ALDH1A1 (0.43) | PKMHTTHPGDCA4NPC1 | |
| SCHEMBL28701506 | 0.84 | L3MBTL1 (0.46) | PKMHTTCA4NPC1RAB9A | |
| Ammonia Solution, Strong SCHEMBL28943711 | 0.83 | L3MBTL1 (0.56) | PKMHTTCA4ALDH1A1L3MBTL1 | |
| SCHEMBL29034925 | 0.83 | PKM (0.60) | PKMHTTHPGDCA4ACP3 | |
| SCHEMBL28388309 | 0.82 | PKM (0.59) | PKMHTTHPGDCA4ACP3 | |
| SCHEMBL28702854 | 0.82 | HPGD (0.50) | HPGDNPC1RAB9AALDH1A1L3MBTL1 | |
| SCHEMBL28702868 | 0.82 | GAA (0.52) | PKMHTTHPGDLTA4HNPC1 | |
| SCHEMBL7162911 | 0.82 | ESR1 (0.57) | PKMHTTHPGDCA4ACP3 |
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-109071578-B | P-chiral phosphine ligand and application thereof in asymmetric synthesis | 巴斯夫欧洲公司 | 2022-01-14 | — | — | CN | disclosed |