Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA4 | P22748 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | 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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL902862 | 0.98 | KMT2A (0.40) | KMT2AHRH3MEN1CA12CA1 | |
| SCHEMBL3727257 | 0.85 | ALDH1A1 (0.41) | KMT2AMAPK1PKMALDH1A1KDM4E | |
| SCHEMBL902864 | 0.79 | ALDH1A1 (0.38) | KMT2AMEN1MAPK1ALDH1A1KDM4E | |
| SCHEMBL902080 | 0.76 | ALDH1A1 (0.39) | KMT2AMEN1ALDH1A1KDM4EGAA | |
| SCHEMBL902099 | 0.76 | ALDH1A1 (0.33) | KMT2AMEN1ALDH1A1TSHRL3MBTL1 | |
| SCHEMBL13123923 | 0.71 | ALDH1A1 (0.46) | KMT2AHRH3MEN1ALDH1A1KDM4E | |
| SCHEMBL901588 | 0.71 | HTT (0.38) | KMT2AMEN1CA12CA1CA2 | |
| SCHEMBL1638946 | 0.71 | CA1 (0.46) | KMT2AMEN1CA12CA1CA2 | |
| SCHEMBL16181025 | 0.65 | NPC1 (0.38) | KMT2AHRH3MEN1MAPK1PKM | |
| SCHEMBL3174809 | 0.64 | DRD2 (0.70) | ALDH1A1GAAMAPTL3MBTL1DRD2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012042227-A1 | COMPOUNDS FOR USE IN THE TREATMENT OF PLANTS | PENINSULA COLLEGE OF MEDICINE AND DENTISTRY, UNIVERSITY OF EXETER (GB) | 2012-04-05 | — | — | WO | disclosed |