Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 1/20 | 0.42 |
| ▸ | PI4KA | P42356 | 1/20 | 0.42 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.38 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.37 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.37 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.37 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.37 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.35 |
| ▸ | GSK3B | P49841 | 1/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | MMP12 | P39900 | 1/20 | 0.35 |
| ▸ | MMP13 | P45452 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2658413 | 0.85 | MBOAT4 (0.40) | PIK3CAPI4KAPI4KBS1PR1SLC6A4 | |
| SCHEMBL29694695 | 0.85 | MBOAT4 (0.40) | PIK3CAPI4KAPI4KBS1PR1SLC6A4 | |
| SCHEMBL21769960 | 0.82 | MAOB (0.38) | MAOBHAO1SLC6A4MMP12MMP13 | |
| SCHEMBL5114909 | 0.77 | PIK3CA (0.46) | PIK3CAPI4KAPI4KBNPC1RAB9A | |
| SCHEMBL22920103 | 0.76 | PIK3CA (0.45) | PIK3CAPI4KAPI4KBS1PR1TLR9 | |
| SCHEMBL6879617 | 0.76 | NOTUM (0.47) | PIK3CAPI4KAPI4KBNPC1RAB9A | |
| SCHEMBL4212545 | 0.73 | MAOB (0.42) | MAOBHAO1NPC1LMNARAB9A | |
| SCHEMBL8423018 | 0.72 | PTGS2 (0.51) | PIK3CAPI4KB | |
| SCHEMBL4415453 | 0.71 | KIF11 (0.47) | PIK3CAPI4KAPI4KBMAOBDYRK1A | |
| SCHEMBL10300271 | 0.71 | ALDH1A1 (0.50) | HAO1SLC6A4MMP12MMP13NISCH |
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-2020039027-A1 | PYRROLIDINE GLYCOSIDASE INHIBITORS | ASCENEURON S. A. (CH) | 2020-02-27 | — | — | WO | disclosed |