Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.38 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | FABP6 | P51161 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | KDM1A | O60341 | 1/20 | 0.35 |
| ▸ | NPY5R | Q15761 | 4/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL21746222 | 0.77 | EPHX2 (0.44) | EPHX2EPHX1KDM1AMAPT | |
| SCHEMBL23033424 | 0.76 | — | — | |
| SCHEMBL774350 | 0.73 | ADH1B (0.50) | TP53EPHX2EPHX1NPSR1FABP6 | |
| SCHEMBL24007252 | 0.73 | ADH1B (0.39) | — | |
| SCHEMBL21746091 | 0.71 | KDM1A (0.36) | KDM1AALDH1A1 | |
| SCHEMBL21746084 | 0.70 | EPHX1 (0.38) | EPHX1 | |
| SCHEMBL22702143 | 0.69 | TP53 (0.42) | TP53EPHX2EPHX1NPSR1FABP6 | |
| SCHEMBL12820051 | 0.69 | TP53 (0.48) | TP53EPHX2EPHX1NPSR1FABP6 | |
| SCHEMBL22702017 | 0.68 | TP53 (0.41) | TP53EPHX2EPHX1NPSR1FABP6 | |
| SCHEMBL5344959 | 0.67 | TP53 (0.50) | TP53EPHX2EPHX1NPSR1FABP6 |
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-2944637-B1 | NITROGEN-CONTAINING HETEROCYLIC COMPOUND OR SALT THEREOF | FUJIFILM CORP (JP) | 2020-02-19 | — | — | EP | disclosed |