Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | RECQL | P46063 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL22716205 | 0.73 | KDM4E (0.33) | CYP1A2CYP3A4CYP2D6CYP2C19KDM4E | |
| SCHEMBL22729409 | 0.72 | KDM4E (0.38) | CYP1A2CYP3A4CYP2D6CYP2C19KDM4E | |
| SCHEMBL30082527 | 0.72 | KDM4E (0.38) | CYP1A2CYP3A4CYP2D6CYP2C19KDM4E | |
| SCHEMBL21393415 | 0.71 | ALDH1A1 (0.32) | — | |
| SCHEMBL22715564 | 0.67 | PIK3C3 (0.33) | CYP3A4KDM4EMAPTRECQLNPSR1 | |
| SCHEMBL1044209 | 0.66 | ALDH1A1 (0.35) | CYP3A4KDM4EMAPTRECQLNPSR1 | |
| SCHEMBL20203314 | 0.66 | — | — | |
| SCHEMBL21393347 | 0.64 | — | — | |
| Pyridine SCHEMBL21226522 | 0.63 | KDM4E (0.35) | KDM4EMAPTRECQLNPSR1 | |
| SCHEMBL6920756 | 0.62 | MEN1 (0.38) | CYP1A2CYP3A4CYP2D6CYP2C19KDM4E |
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-2019182925-A1 | OXADIAZOLE TRANSIENT RECEPTOR POTENTIAL CHANNEL INHIBITORS | GENENTECH, INC. (US) | 2019-09-26 | — | — | WO | disclosed |