Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | GSR | P00390 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | CTSD | P07339 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28271601 | 0.80 | ALDH1A1 (0.39) | NPSR1CYP2D6GSRALDH1A1MAPT | |
| SCHEMBL27524142 | 0.78 | ALDH1A1 (0.50) | SMN1; SMN2GSRALDH1A1L3MBTL1LMNA | |
| SCHEMBL2029476 | 0.74 | MAPT (0.41) | NPSR1CYP2D6SMN1; SMN2GSRALDH1A1 | |
| SCHEMBL27993686 | 0.73 | GSR (0.37) | NPSR1CYP2D6SMN1; SMN2GSRALDH1A1 | |
| SCHEMBL2325620 | 0.73 | AOC3 (0.39) | NPSR1GSRALDH1A1MAPTL3MBTL1 | |
| SCHEMBL6129084 | 0.73 | GSR (0.42) | CYP2D6GSRALDH1A1LMNAKMT2A | |
| SCHEMBL7511468 | 0.73 | HDAC3 (0.49) | NPSR1CYP1A2CYP2D6PKMSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL21219507 | 0.72 | GSR (0.41) | CYP2D6GSRALDH1A1LMNAKMT2A | |
| SCHEMBL38107 | 0.71 | NPSR1 (0.43) | NPSR1CYP1A2CYP2D6PKMSMN1; SMN2 | |
| SCHEMBL8930553 | 0.70 | GSR (0.40) | CYP1A2SMN1; SMN2GSRALDH1A1MAPT |
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-104231744-A | Ink, ink cartridge, ink jet recording device, ink jet ink printed matter, compound, and composition | RICOH CO LTD | 2014-12-24 | — | — | CN | disclosed |