Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDCD1 | Q15116 | 1/20 | 0.38 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.38 |
| ▸ | CYP4F2 | P78329 | 2/20 | 0.37 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL477598 | 0.85 | CYP4F2 (0.42) | PDCD1CD274CYP4F2CYP4A11GAA | |
| SCHEMBL15255042 | 0.79 | SLC6A2 (0.48) | GAAALOX12CYP2C19ALDH1A1LMNA | |
| SCHEMBL358741 | 0.76 | RIPK1 (0.47) | PDCD1CD274CYP4F2CYP4A11GAA | |
| SCHEMBL21727713 | 0.72 | APOBEC3G (0.40) | PDCD1CD274CYP4F2CYP4A11GAA | |
| SCHEMBL41139 | 0.69 | APOBEC3G (0.60) | PDCD1CD274CYP4F2CYP4A11GAA | |
| SCHEMBL29366632 | 0.69 | APOBEC3G (0.60) | PDCD1CD274CYP4F2CYP4A11GAA | |
| SCHEMBL282444 | 0.69 | CYP4F2 (0.53) | PDCD1CD274CYP4F2CYP4A11GAA | |
| SCHEMBL282419 | 0.68 | GABRA1 (0.52) | PDCD1CD274CYP4F2CYP4A11GAA | |
| SCHEMBL11865324 | 0.68 | NCF1 (0.40) | ALDH1A1HTR1ASLC6A2 | |
| SCHEMBL31427515 | 0.68 | SLC6A2 (0.45) | CYP2C19LMNASLC6A2TAAR1 |
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-2018026371-A1 | DUAL NAV1.2/5HT2A INHIBITORS FOR TREATING CNS DISORDERS | SUNOVION PHARMACEUTICALS INC. (US) | 2018-02-08 | — | — | WO | disclosed |