Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTOR | P42345 | 2/20 | 0.40 |
| ▸ | MAP3K12 | Q12852 | 6/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.33 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.33 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.32 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.32 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.32 |
| ▸ | PARP11 | Q9NR21 | 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 | |
|---|---|---|---|---|
| SCHEMBL30016131 | 1.00 | MTOR (0.40) | MTORMAP3K12KDM4EMAPTTRPV1 | |
| SCHEMBL24698853 | 0.84 | ALDH1A1 (0.37) | MTORKDM4EMAPTTRPV1HRH3 | |
| SCHEMBL24698177 | 0.84 | PDE4A (0.35) | MTORMAP3K12GRM2 | |
| SCHEMBL29134519 | 0.83 | PIK3R1 (0.35) | MAP3K12PDK1PDK2PDK3PDK4 | |
| SCHEMBL30016476 | 0.83 | PIK3R1 (0.35) | MAP3K12PDK1PDK2PDK3PDK4 | |
| SCHEMBL24697783 | 0.83 | PIK3R1 (0.35) | MAP3K12PDK1PDK2PDK3PDK4 | |
| SCHEMBL24698813 | 0.82 | IGF1R (0.37) | KDM4EMAPTPARP10PARP11 | |
| SCHEMBL30015981 | 0.81 | TGFBR1 (0.40) | MAP3K12 | |
| SCHEMBL24697693 | 0.81 | MEN1 (0.34) | MAP3K12KDM4ETRPV1PDK1PDK2 | |
| SCHEMBL30015933 | 0.81 | MAP4K4 (0.37) | MAP3K12KCNH2HRH3 |
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-2022212194-A1 | KHK INHIBITORS | GILEAD SCIENCES, INC. (US) | 2022-10-06 | — | — | WO | disclosed |