Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SOS1 | Q07889 | 7/20 | 0.47 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.38 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.36 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.36 |
| ▸ | HTR6 | P50406 | 4/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HTR7 | P34969 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.35 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29861198 | 0.83 | SOS1 (0.49) | SOS1HTR6 | |
| SCHEMBL29861305 | 0.79 | CYP1A2 (0.36) | MKNK1MKNK2CYP1A2CYP3A4TSHR | |
| SCHEMBL29861354 | 0.78 | SOS1 (0.47) | SOS1MKNK1MKNK2CYP1A2CYP3A4 | |
| SCHEMBL29861309 | 0.77 | CYP1A2 (0.35) | MKNK1MKNK2CYP1A2CYP3A4TSHR | |
| SCHEMBL29862028 | 0.77 | SOS1 (0.49) | SOS1MKNK1MKNK2CYP1A2CYP3A4 | |
| SCHEMBL23239820 | 0.68 | CYP1A2 (0.46) | MKNK1MKNK2CYP1A2CYP3A4TSHR | |
| SCHEMBL29861795 | 0.68 | CYP1A2 (0.46) | MKNK1MKNK2CYP1A2CYP3A4TSHR | |
| SCHEMBL30618309 | 0.68 | FGFR1 (0.67) | — | |
| SCHEMBL9982855 | 0.65 | PIM1 (0.33) | HRH3 | |
| SCHEMBL5062585 | 0.64 | CYP1A2 (0.41) | MKNK2CYP1A2CYP3A4TSHRCLK4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116425742-A | Bicyclic heteroaryl compounds and uses thereof | 锐新医药公司 | 2023-07-14 | — | — | CN | disclosed |
| CN-114901662-A | Bicyclic heteroaryl compounds and uses thereof | 锐新医药公司 | 2022-08-12 | — | — | CN | disclosed |