Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSR | P00390 | 10/20 | 0.54 |
| ▸ | CA2 | P00918 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 2/20 | 0.30 |
| ▸ | RAB9A | P51151 | 2/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL323260 | 1.00 | GSR (0.54) | GSRCA2ALDH1A1BCHECA1 | |
| SCHEMBL1774751 | 1.00 | GSR (0.54) | GSRCA2ALDH1A1BCHECA1 | |
| SCHEMBL7763205 | 1.00 | GSR (0.54) | GSRCA2ALDH1A1BCHECA1 | |
| SCHEMBL3804843 | 1.00 | GSR (0.54) | GSRCA2ALDH1A1BCHECA1 | |
| Ammonia Solution, Strong SCHEMBL10427644 | 1.00 | GSR (0.54) | GSRCA2ALDH1A1BCHECA1 | |
| SCHEMBL324551 | 0.97 | — | — | |
| Nitric Acid SCHEMBL8006200 | 0.93 | GSR (0.53) | GSRCA2ALDH1A1BCHECA1 | |
| SCHEMBL14499693 | 0.92 | — | — | |
| Bicarbonate SCHEMBL10444461 | 0.91 | GSR (0.52) | GSRCA2ALDH1A1BCHEMAPT | |
| SCHEMBL10640834 | 0.89 | GSR (0.46) | GSRCA2ALDH1A1BCHECA1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111465843-A | Laser desorption ionization method, mass spectrometry method, sample support, and method for producing sample support | 浜松光子学株式会社 | 2020-07-28 | — | — | CN | disclosed |
| CN-111406211-A | Laser desorption ionization method and mass spectrometry | 浜松光子学株式会社 | 2020-07-10 | — | — | CN | disclosed |
| US-4448587-A | ALKYL NITRATES AND ALKOXYALKYL NITRATES AS ADDITIVES | ETHYL CORPORATION (US) | 1984-05-15 | — | — | US | disclosed |