Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS3 | P29474 | 1/20 | 0.44 |
| ▸ | NOS1 | P29475 | 1/20 | 0.44 |
| ▸ | NOS2 | P35228 | 1/20 | 0.44 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.40 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.40 |
| ▸ | MET | P08581 | 4/20 | 0.36 |
| ▸ | MAP3K12 | Q12852 | 2/20 | 0.36 |
| ▸ | CDK1 | P06493 | 1/20 | 0.35 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.35 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.35 |
| ▸ | CDK2 | P24941 | 1/20 | 0.35 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.35 |
| ▸ | GABRP | O00591 | 1/20 | 0.34 |
| ▸ | GABRD | O14764 | 1/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.34 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.34 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.34 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.34 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.34 |
| ▸ | GABRA3 | P34903 | 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 | |
|---|---|---|---|---|
| SCHEMBL24354756 | 1.00 | NOS3 (0.44) | NOS3NOS1NOS2MCHR1SLC2A1 | |
| SCHEMBL19754784 | 0.83 | MCHR1 (0.40) | MCHR1SLC2A1METMAP3K12CDK1 | |
| SCHEMBL17680610 | 0.82 | NOS3 (0.50) | NOS3NOS1NOS2METMAP3K12 | |
| SCHEMBL18050648 | 0.82 | MET (0.49) | MCHR1SLC2A1METMAP3K12CDK1 | |
| SCHEMBL10174184 | 0.77 | NOS3 (0.48) | NOS3NOS1NOS2METMAP3K12 | |
| SCHEMBL18072070 | 0.77 | NOS3 (0.52) | NOS3NOS1NOS2CYP2A6TLR8 | |
| SCHEMBL12993400 | 0.73 | JAK2 (0.49) | NOS3NOS1NOS2METMAP3K12 | |
| SCHEMBL18050632 | 0.73 | AAK1 (0.41) | MCHR1SLC2A1MAP3K12 | |
| SCHEMBL16372679 | 0.72 | TDP1 (0.42) | MCHR1SLC2A1 | |
| SCHEMBL2668576 | 0.72 | NOS3 (0.56) | NOS3NOS1NOS2CYP2A6TLR8 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3268373-B1 | TRICYCLIC DLK INHIBITORS AND USES THEREOF | HOFFMANN LA ROCHE (CH) | 2022-04-27 | — | — | EP | disclosed |
| WO-2016142310-A1 | TRICYCLIC DLK INHIBITORS AND USES THEREOF | F. HOFFMANN-LA ROCHE AG (CH) | 2016-09-15 | — | — | WO | disclosed |