Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 8/20 | 0.65 |
| ▸ | KMT2A | Q03164 | 8/20 | 0.65 |
| ▸ | ABCG2 | Q9UNQ0 | 10/20 | 0.58 |
| ▸ | GAA | P10253 | 4/20 | 0.58 |
| ▸ | POLB | P06746 | 3/20 | 0.55 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.55 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.55 |
| ▸ | GBA1 | P04062 | 1/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.53 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.53 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.51 |
| ▸ | KDM1A | O60341 | 1/20 | 0.50 |
| ▸ | PDE5A | O76074 | 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 | |
|---|---|---|---|---|
| SCHEMBL3993832 | 0.79 | MEN1 (0.60) | MEN1KMT2AABCG2GAAPOLB | |
| SCHEMBL3993836 | 0.79 | MEN1 (0.60) | MEN1KMT2AABCG2GAAPOLB | |
| SCHEMBL1061916 | 0.74 | ABCG2 (1.00) | MEN1KMT2AABCG2GAAPOLB | |
| SCHEMBL4375701 | 0.72 | ABCG2 (0.47) | ABCG2MAPTPDE5A | |
| SCHEMBL4873443 | 0.70 | PDE5A (0.58) | MEN1KMT2AABCG2POLBMAPT | |
| SCHEMBL3998359 | 0.70 | PDE5A (0.58) | MEN1KMT2AABCG2POLBMAPT | |
| Nifurquinazol SCHEMBL193816 | 0.70 | POLB (0.48) | MEN1KMT2AABCG2POLBMAPT | |
| SCHEMBL8104012 | 0.69 | MEN1 (1.00) | MEN1KMT2AABCG2GAAPOLB | |
| SCHEMBL12316824 | 0.69 | GAA (1.00) | MEN1KMT2AABCG2GAAPOLB | |
| SCHEMBL2294276 | 0.69 | ABCG2 (0.78) | MEN1KMT2AABCG2GAAPOLB |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-3974277-A | PESTICIDES | DIAMOND SHAMROCK CORPORATION (US) | 1976-08-10 | — | — | US | disclosed |
| US-3973021-A | 2-[2-(5-Nitro-2-furyl)vinyl]-4-(phydroxyanilino)quinazoline as a bactericide | DIAMOND SHAMROCK CORPORATION (US) | 1976-08-03 | — | — | US | disclosed |
| US-3970648-A | PESTICIDE, ANIMAL GROWTH REGULATOR | DIAMOND SHAMROCK CORPORATION (US) | 1976-07-20 | — | — | US | disclosed |