Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.67 |
| ▸ | MAPT | P10636 | 7/20 | 0.56 |
| ▸ | MEN1 | O00255 | 6/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.56 |
| ▸ | HTT | P42858 | 3/20 | 0.56 |
| ▸ | RAB9A | P51151 | 3/20 | 0.56 |
| ▸ | NPC1 | O15118 | 2/20 | 0.56 |
| ▸ | PKM | P14618 | 1/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.56 |
| ▸ | TSHR | P16473 | 3/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | CASP3 | P42574 | 2/20 | 0.47 |
| ▸ | SENP8 | Q96LD8 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL21841396 | 1.00 | ALDH1A1 (0.67) | ALDH1A1MAPTMEN1KMT2AHTT | |
| SCHEMBL24385153 | 0.88 | ALDH1A1 (0.50) | ALDH1A1MAPTMEN1KMT2AHTT | |
| Nitrosobenzene SCHEMBL103117 | 0.88 | — | — | |
| Nitrosobenzene SCHEMBL28014686 | 0.88 | ALDH1A1 (0.59) | ALDH1A1MAPTMEN1KMT2AHTT | |
| Nitrosobenzene SCHEMBL3176061 | 0.88 | — | — | |
| Nitrosobenzene SCHEMBL28230134 | 0.85 | — | — | |
| Nitrosobenzene SCHEMBL27874353 | 0.85 | — | — | |
| Nitrosobenzene SCHEMBL27642000 | 0.85 | — | — | |
| Nitrosobenzene SCHEMBL30901881 | 0.85 | — | — | |
| Nitrosobenzene SCHEMBL26970890 | 0.85 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1394221-B1 | Carbonaceous material | EVONIK DEGUSSA GMBH (DE) | 2009-09-09 | — | — | EP | disclosed |