Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.70 |
| ▸ | HTT | P42858 | 1/20 | 0.70 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.67 |
| ▸ | MAPT | P10636 | 4/20 | 0.62 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 2/20 | 0.52 |
| ▸ | PKM | P14618 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL11026334 | 0.85 | MAPT (0.54) | ALDH1A1HTTMAPK1MAPTVCAM1 | |
| SCHEMBL18556821 | 0.85 | VCAM1 (0.75) | ALDH1A1HTTMAPTVCAM1POLB | |
| SCHEMBL23121352 | 0.83 | MAPK1 (0.70) | ALDH1A1HTTMAPK1MAPTVCAM1 | |
| SCHEMBL14433417 | 0.82 | HTT (0.58) | ALDH1A1HTTMAPK1MAPTPKM | |
| SCHEMBL3705510 | 0.81 | VCAM1 (0.73) | ALDH1A1HTTMAPK1VCAM1KDM4E | |
| SCHEMBL9491262 | 0.80 | VCAM1 (0.71) | ALDH1A1HTTMAPK1VCAM1KDM4E | |
| SCHEMBL10336394 | 0.80 | VCAM1 (0.71) | ALDH1A1HTTMAPK1VCAM1KDM4E | |
| SCHEMBL3277738 | 0.79 | POLB (0.51) | ALDH1A1HTTMAPK1MAPTVCAM1 | |
| SCHEMBL31689555 | 0.78 | GAA (0.54) | ALDH1A1HTTMAPK1MAPTPKM | |
| SCHEMBL12776234 | 0.78 | ALDH1A1 (0.62) | ALDH1A1HTTMAPK1MAPTVCAM1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5086128-A | HIGH MOLECULAR WEIGHT ARYLENE SULPHIDE POLYMER MELT MIXED WITH AROMATIC NITRO COMPOUND | BAYER AKTIENGESELLSCHAFT (DE) | 1992-02-04 | — | — | US | disclosed |