Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 4/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | MDM4 | O15151 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 2/20 | 0.43 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.43 |
| ▸ | TLR2 | O60603 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7599890 | 0.91 | CASP3 (0.52) | CASP3MDM4TP53PIN1TLR2 | |
| SCHEMBL8132183 | 0.88 | CASP3 (0.48) | CASP3CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL1486214 | 0.86 | CASP3 (0.52) | CASP3CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL118209 | 0.86 | CASP3 (0.52) | CASP3CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL1486287 | 0.86 | CASP3 (0.52) | CASP3CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL6038102 | 0.86 | CASP3 (0.52) | CASP3CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL1564185 | 0.86 | CASP3 (0.52) | CASP3CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL119497 | 0.86 | CASP3 (0.52) | CASP3CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL30896049 | 0.86 | CASP3 (0.52) | CASP3CYP3A4CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL30896048 | 0.86 | CASP3 (0.52) | CASP3CYP3A4CYP2D6CYP2C9CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| JP-2002503673-A | — | — | 2002-02-05 | — | — | JP | claimed |
| EP-1054891-A1 | PRODRUGS | MEDIVIR AB (SE) | 2000-11-29 | — | — | EP | claimed |
| WO-1999041275-A1 | PRODRUGS | MEDIVIR AB (SE) | 1999-08-19 | — | — | WO | claimed |