Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 5/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | AR | P10275 | 3/20 | 0.40 |
| ▸ | DHFR | P00374 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.37 |
| ▸ | HTR1A | P08908 | 2/20 | 0.37 |
| ▸ | HTR3A | P46098 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL12923348 | 1.00 | CYP1A2 (0.47) | CYP1A2CYP3A4CYP2C9CYP2C19KDM4E | |
| SCHEMBL17612235 | 0.90 | L3MBTL1 (0.47) | CYP1A2CYP3A4CYP2C9CYP2C19KDM4E | |
| SCHEMBL497284 | 0.84 | KDM4E (0.51) | CYP1A2CYP3A4CYP2C9CYP2C19KDM4E | |
| SCHEMBL20591218 | 0.84 | CYP1A2 (0.54) | CYP1A2CYP3A4CYP2C9CYP2C19KDM4E | |
| SCHEMBL20510897 | 0.83 | CYP1A2 (0.53) | CYP1A2CYP3A4CYP2C9CYP2C19KDM4E | |
| SCHEMBL11388978 | 0.83 | HPGD (0.51) | CYP1A2CYP3A4CYP2C9CYP2C19KDM4E | |
| SCHEMBL9644772 | 0.83 | DHFR (0.43) | CYP1A2CYP3A4CYP2C9CYP2C19KDM4E | |
| SCHEMBL5074845 | 0.82 | L3MBTL1 (0.45) | CYP1A2CYP3A4CYP2C9CYP2C19KDM4E | |
| SCHEMBL2075358 | 0.82 | L3MBTL1 (0.42) | CYP1A2CYP3A4CYP2C9CYP2C19KDM4E | |
| SCHEMBL13907657 | 0.82 | CYP1A2 (0.52) | CYP1A2CYP3A4CYP2C9CYP2C19KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-110461814-B | Resin blends, prepregs and articles containing a phthalonitrile reactive diluent and a bisphthalonitrile resin | 3M创新有限公司 | 2023-04-14 | — | — | CN | disclosed |