Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.56 |
| ▸ | MAPT | P10636 | 3/20 | 0.56 |
| ▸ | RORC | P51449 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | CA9 | Q16790 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | MITF | O75030 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL1553581 | 0.84 | KMT2A (0.63) | ALDH1A1MAPTKMT2AMEN1LMNA | |
| SCHEMBL14805391 | 0.81 | TP53 (0.49) | CYP1A2CYP2C19ALDH1A1MAPTKMT2A | |
| SCHEMBL1976549 | 0.80 | ALDH1A1 (0.51) | ALDH1A1MAPTKMT2AKDM4EMEN1 | |
| SCHEMBL24254516 | 0.80 | KMT2A (0.51) | CYP1A2CYP2C9CYP2C19ALDH1A1KMT2A | |
| SCHEMBL3687471 | 0.79 | KDM4E (0.50) | ALDH1A1GAAKDM4ESMN1; SMN2 | |
| SCHEMBL14098226 | 0.78 | CYP1A2 (0.65) | CYP1A2CYP2C9CYP2C19ALDH1A1MAPT | |
| SCHEMBL10874979 | 0.78 | TDP1 (0.70) | CYP1A2CYP2C9CYP2C19ALDH1A1MAPT | |
| SCHEMBL9182141 | 0.78 | EPHX1 (0.74) | CYP1A2CYP2C9CYP2C19ALDH1A1MAPT | |
| SCHEMBL2564265 | 0.77 | ALDH1A1 (0.47) | CYP1A2CYP2C9CYP2C19ALDH1A1MAPT | |
| SCHEMBL5256278 | 0.77 | CYP1A2 (0.63) | CYP1A2CYP2C9CYP2C19ALDH1A1MAPT |
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-2012087938-A1 | QUINAZOLINONE DERIVATIVES AS ANTIVIRAL AGENTS | GLAXOSMITHKLINE LLC (US) | 2012-06-28 | — | — | WO | disclosed |