Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CD | O00329 | 1/20 | 0.46 |
| ▸ | PER2 | O15055 | 1/20 | 0.36 |
| ▸ | CRY2 | Q49AN0 | 1/20 | 0.36 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.32 |
| ▸ | NQO2 | P16083 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | CNR1 | P21554 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 1/20 | 0.31 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8157591 | 0.77 | PIK3CD (0.50) | PIK3CDPER2CRY2GRM2KDM4E | |
| SCHEMBL21988582 | 0.76 | PIK3CD (0.41) | PIK3CDPER2 | |
| SCHEMBL21990967 | 0.75 | PRMT5 (0.33) | PIK3CDPER2CRY2 | |
| SCHEMBL21988583 | 0.75 | PIK3CD (0.47) | PIK3CDPER2 | |
| SCHEMBL17662303 | 0.75 | PIK3CD (0.44) | PIK3CDGRM2NPC1RAB9A | |
| SCHEMBL8163857 | 0.72 | PIK3CD (0.56) | PIK3CDPER2CRY2GRM2PDK2 | |
| SCHEMBL4874421 | 0.70 | PIK3CD (0.43) | PIK3CDGRM2KDM4E | |
| SCHEMBL17662296 | 0.70 | PIK3CD (0.45) | PIK3CDPER2CRY2PDK2KDM4E | |
| SCHEMBL17662294 | 0.70 | PIK3CD (0.49) | PIK3CDPER2CRY2GRM2PDK2 | |
| SCHEMBL24909657 | 0.69 | PIK3CD (0.89) | PIK3CDPER2CRY2GRM2KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-3201205-B1 | BORONIC ACID DERIVATIVES | MERCK PATENT GMBH (DE) | 2020-05-13 | — | — | EP | disclosed |