Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | GMNN | O75496 | 1/20 | 0.47 |
| ▸ | TTR | P02766 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | THRB | P10828 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | BLM | P54132 | 1/20 | 0.47 |
| ▸ | GFER | P55789 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28295511 | 0.88 | MAPK1 (0.49) | MAPK1ALDH1A1VCAM1KDM4ELMNA | |
| SCHEMBL14956593 | 0.87 | ALDH1A1 (0.50) | MAPK1ALDH1A1VCAM1KDM4ELMNA | |
| SCHEMBL28326686 | 0.86 | TSHR (0.49) | MAPK1ALDH1A1VCAM1KDM4ELMNA | |
| Nitrous Acid SCHEMBL28260974 | 0.85 | MAPK1 (0.47) | MAPK1ALDH1A1VCAM1KDM4ELMNA | |
| SCHEMBL24635525 | 0.84 | MAPK1 (0.46) | MAPK1ALDH1A1VCAM1KDM4ELMNA | |
| SCHEMBL5070586 | 0.82 | ALDH1A1 (0.59) | MAPK1ALDH1A1KDM4ELMNAMAPT | |
| SCHEMBL28299590 | 0.82 | ALDH1A1 (0.46) | MAPK1ALDH1A1VCAM1KDM4ELMNA | |
| SCHEMBL22070445 | 0.81 | DTYMK (0.50) | ALDH1A1KDM4ELMNAMAPTMEN1 | |
| SCHEMBL1349352 | 0.81 | MAPK1 (0.51) | MAPK1ALDH1A1VCAM1KDM4ELMNA | |
| SCHEMBL11107590 | 0.80 | MAPK1 (0.54) | MAPK1ALDH1A1VCAM1KDM4ELMNA |
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-0843671-A1 | HETEROCYCLIC COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | GLAXO GROUP LIMITED (GB) | 1998-05-27 | — | — | EP | disclosed |