Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.52 |
| ▸ | KCNA3 | P22001 | 3/20 | 0.44 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.43 |
| ▸ | PTGES | O14684 | 1/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | GFER | P55789 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | PSMG3 | Q9BT73 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL25952524 | 0.92 | CYP3A4 (0.52) | CYP3A4KCNA3ABCB1PTGESALOX5 | |
| SCHEMBL25952538 | 0.92 | CYP3A4 (0.52) | CYP3A4KCNA3ABCB1PTGESALOX5 | |
| SCHEMBL684711 | 0.85 | KCNA3 (0.49) | CYP3A4KCNA3ABCB1PSMG3 | |
| Methoxymethane SCHEMBL9752629 | 0.82 | CYP3A4 (0.53) | CYP3A4KCNA3ABCB1MEN1HPGD | |
| SCHEMBL29745831 | 0.82 | CYP3A4 (0.46) | CYP3A4KCNA3ABCB1MEN1POLB | |
| Mallotophenone SCHEMBL31237811 | 0.81 | CYP3A4 (0.46) | CYP3A4KCNA3ABCB1PTGESALOX5 | |
| SCHEMBL25952532 | 0.81 | CYP3A4 (0.42) | CYP3A4KCNA3ABCB1 | |
| SCHEMBL9752724 | 0.79 | CYP3A4 (0.48) | CYP3A4PTGESMEN1HPGDKMT2A | |
| SCHEMBL16666701 | 0.79 | CYP3A4 (0.52) | CYP3A4KCNA3ABCB1PTGESALOX5 | |
| SCHEMBL21931371 | 0.79 | CYP3A4 (0.47) | CYP3A4KCNA3ABCB1MEN1POLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-1991009595-A1 | ANTI-VIRAL COMPOSITIONS | SMITHKLINE BEECHAM CORPORATION (US) | 1991-07-11 | — | — | WO | disclosed |