Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHODH | Q02127 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 6/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.34 |
| ▸ | CXCR1 | P25024 | 2/20 | 0.34 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | DRD3 | P35462 | 1/20 | 0.31 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.31 |
| ▸ | PLA2G4A | P47712 | 1/20 | 0.31 |
| ▸ | MGAM | O43451 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | SI | P14410 | 1/20 | 0.31 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL20122753 | 0.80 | TBK1 (0.33) | ACHECYP1A2CYP2C19TBK1MAOA | |
| SCHEMBL20122733 | 0.77 | MAOA (0.42) | ACHECYP1A2MAOAKDM4EALDH1A1 | |
| SCHEMBL29756399 | 0.70 | MEN1 (0.40) | CYP1A2CYP2C19KDM4EALDH1A1GAA | |
| SCHEMBL23097174 | 0.67 | PRKAB2 (0.31) | — | |
| SCHEMBL29756362 | 0.65 | KDM4E (0.51) | ACHECYP1A2MAOAKDM4EALDH1A1 | |
| SCHEMBL29756454 | 0.63 | DYRK1A (0.45) | KDM4EALDH1A1HPGDGAA | |
| SCHEMBL3461962 | 0.62 | RXFP1 (0.41) | HRH4KDM4EALDH1A1HPGDGAA | |
| SCHEMBL29756406 | 0.61 | PTPN5 (0.52) | CYP1A2CYP2C19KDM4EALDH1A1HPGD | |
| SCHEMBL20122732 | 0.61 | PRKAB2 (0.48) | ACHECYP1A2MAOAKDM4EALDH1A1 | |
| SCHEMBL29756387 | 0.61 | CHEK2 (0.50) | — |
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-110382496-B | Substituted pyrido [3,4-b ] indoles for the treatment of cartilage disorders | 赛诺菲 | 2022-08-09 | — | — | CN | disclosed |