Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 3/20 | 0.45 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | P2RY1 | P47900 | 5/20 | 0.35 |
| ▸ | KDR | P35968 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | PDE4A | P27815 | 1/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.33 |
| ▸ | KIT | P10721 | 1/20 | 0.33 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.33 |
| ▸ | FGFR2 | P21802 | 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 | |
|---|---|---|---|---|
| SCHEMBL12303836 | 0.71 | KDM4E (0.48) | CYP2C19S1PR3KDM4EMEN1CYP1A2 | |
| SCHEMBL12303378 | 0.69 | CYP2C19 (0.43) | CYP2C19KDM4EMEN1CYP1A2KMT2A | |
| SCHEMBL12303376 | 0.68 | RPS6KB1 (0.45) | CYP2C19KDM4EMEN1CYP1A2KMT2A | |
| SCHEMBL12303374 | 0.68 | CYP2C19 (0.45) | CYP2C19KDM4EMEN1CYP1A2KMT2A | |
| SCHEMBL12303787 | 0.65 | CYP2C19 (0.81) | CYP2C19S1PR3CYP3A4CYP2C9 | |
| SCHEMBL12303788 | 0.65 | CYP2C19 (0.80) | CYP2C19CYP3A4CYP2C9P2RY1 | |
| SCHEMBL12303348 | 0.63 | P2RY1 (0.50) | CYP2C19KDM4EMEN1CYP1A2KMT2A | |
| SCHEMBL12303350 | 0.62 | P2RY1 (0.49) | CYP2C19KDM4EMEN1CYP1A2KMT2A | |
| SCHEMBL12303858 | 0.60 | KDM4E (0.43) | CYP2C19S1PR3KDM4EMEN1CYP1A2 | |
| SCHEMBL12303859 | 0.60 | KDM4E (0.45) | CYP2C19S1PR3KDM4EMEN1CYP1A2 |
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-2011032277-A1 | QUINAZOLINONE DERIVATIVES AS VIRAL POLYMERASE INHIBITORS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2011-03-24 | — | — | WO | disclosed |