Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 5/20 | 0.53 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.39 |
| ▸ | PLA2G5 | P39877 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 4/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | 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 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | FASN | P49327 | 2/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9752724 | 0.92 | CYP3A4 (0.48) | CYP3A4PLA2G2APLA2G5KDM4ECYP1A2 | |
| SCHEMBL10607894 | 0.87 | CYP3A4 (0.48) | CYP3A4PLA2G2APLA2G5KDM4ECYP1A2 | |
| SCHEMBL9752628 | 0.82 | CYP3A4 (0.52) | CYP3A4MEN1KMT2AHPGDLMNA | |
| SCHEMBL26797236 | 0.81 | CYP3A4 (0.48) | CYP3A4PLA2G2APLA2G5KDM4ECYP1A2 | |
| SCHEMBL6023652 | 0.81 | CYP3A4 (0.48) | CYP3A4CYP1A2MEN1KMT2ATHRB | |
| SCHEMBL25952524 | 0.78 | CYP3A4 (0.52) | CYP3A4MEN1KMT2AHPGDLMNA | |
| SCHEMBL1772390 | 0.76 | CYP3A4 (0.41) | CYP3A4PLA2G2APLA2G5KDM4ECYP1A2 | |
| SCHEMBL9532473 | 0.74 | CYP3A4 (0.47) | CYP3A4PLA2G2APLA2G5KDM4ECYP1A2 | |
| SCHEMBL5838924 | 0.74 | CYP3A4 (0.47) | CYP3A4PLA2G2APLA2G5KDM4ECYP1A2 | |
| Methoxymethane SCHEMBL9752688 | 0.73 | CYP3A4 (0.56) | CYP3A4PLA2G2APLA2G5KDM4EMEN1 |
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 |