Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | SYK | P43405 | 1/20 | 0.39 |
| ▸ | RPS6KB1 | P23443 | 14/20 | 0.38 |
| ▸ | AKT1 | P31749 | 5/20 | 0.38 |
| ▸ | CCR5 | P51681 | 2/20 | 0.36 |
| ▸ | TGFBR1 | P36897 | 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 | |
|---|---|---|---|---|
| SCHEMBL3722179 | 0.77 | SMN1; SMN2 (0.42) | MEN1KMT2ASYK | |
| SCHEMBL3713598 | 0.75 | MEN1 (0.36) | CYP3A4MEN1KMT2ASYKCCR5 | |
| SCHEMBL2713930 | 0.73 | OPRM1 (0.39) | CYP3A4SYKCCR5TGFBR1 | |
| SCHEMBL30315919 | 0.66 | BCAT2 (0.46) | MEN1KMT2ASYKRPS6KB1AKT1 | |
| SCHEMBL11788207 | 0.65 | SLC6A2 (0.45) | CYP3A4MEN1KMT2ACCR5 | |
| SCHEMBL14640497 | 0.65 | SLC6A2 (0.45) | CYP3A4MEN1KMT2ACCR5 | |
| SCHEMBL29558406 | 0.65 | CCR5 (0.34) | CYP3A4MEN1KMT2ACCR5 | |
| SCHEMBL3823060 | 0.64 | PARP1 (0.38) | SYKRPS6KB1AKT1 | |
| Hydrochloric Acid SCHEMBL11789965 | 0.63 | SLC6A2 (0.44) | CYP3A4MEN1KMT2ACCR5 | |
| SCHEMBL2219515 | 0.63 | CTNNB1 (0.50) | MEN1KMT2ARPS6KB1AKT1 |
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-2010129802-A1 | INHIBITORS OF JAK | PORTOLA PHARMACEUTICALS, INC. (US) | 2010-11-11 | — | — | WO | claimed |