Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8352109 | 0.88 | PTGS1 (0.38) | CYP1A2CYP3A4MAPT | |
| SCHEMBL8346385 | 0.75 | PGK1 (0.42) | CYP1A2CYP3A4MAPT | |
| SCHEMBL8347708 | 0.74 | VNN1 (0.32) | — | |
| SCHEMBL8351298 | 0.73 | KDM4E (0.37) | CYP1A2CYP3A4MAPT | |
| SCHEMBL8349224 | 0.71 | EED (0.30) | — | |
| SCHEMBL8942327 | 0.69 | KDM4E (0.38) | CYP1A2CYP3A4MAPT | |
| SCHEMBL8349375 | 0.68 | LMNA (0.33) | — | |
| SCHEMBL8346831 | 0.67 | SIRT6 (0.31) | — | |
| SCHEMBL8346430 | 0.64 | — | — | |
| SCHEMBL1901476 | 0.62 | ALDH1A1 (0.60) | CYP1A2MAPT |
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-5958904-A | Phosphonomethyl-imidazo 1,2-A! pyrimidine-2-carboxylic acid compounds for treatment of neurotoxic injury | G.D. SEARLE & CO. (US) | 1999-09-28 | — | — | US | disclosed |