Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 1/20 | 0.45 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.45 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.45 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAPGEF4 | Q8WZA2 | 2/20 | 0.41 |
| ▸ | CLCN2 | P51788 | 1/20 | 0.39 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.39 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.39 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL12321558 | 1.00 | PDK1 (0.45) | PDK1PDK2PDK3PDK4RAB9A | |
| SCHEMBL5768693 | 0.81 | RAB9A (0.47) | RAB9ANPC1RAPGEF4TAS1R3TAS1R1 | |
| SCHEMBL19681892 | 0.80 | CYP3A4 (0.38) | RAB9ANPC1RAPGEF4MAPTMEN1 | |
| SCHEMBL5360509 | 0.79 | PDK1 (0.47) | PDK1PDK2PDK3PDK4RAB9A | |
| SCHEMBL11404618 | 0.79 | PDK1 (0.47) | PDK1PDK2PDK3PDK4RAB9A | |
| SCHEMBL3231268 | 0.79 | ALDH1A1 (0.50) | PDK1PDK2PDK3PDK4RAB9A | |
| SCHEMBL19681873 | 0.78 | L3MBTL1 (0.41) | RAB9ANPC1RAPGEF4MAPTMEN1 | |
| SCHEMBL1679559 | 0.78 | RAPGEF4 (0.52) | PDK1PDK2PDK3PDK4RAPGEF4 | |
| Hydrochloric Acid SCHEMBL3619887 | 0.77 | ALDH1A1 (0.48) | PDK1PDK2PDK3PDK4RAB9A | |
| SCHEMBL12889181 | 0.77 | HPGD (0.45) | RAPGEF4MEN1ALDH1A1KMT2AHPGD |
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-112409186-B | Method for synthesizing N-methylaniline in water | 南京理工大学 | 2022-12-13 | — | — | CN | disclosed |