Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | CTSL | P07711 | 1/20 | 0.51 |
| ▸ | CTSB | P07858 | 1/20 | 0.51 |
| ▸ | CTSS | P25774 | 1/20 | 0.51 |
| ▸ | CTSK | P43235 | 1/20 | 0.51 |
| ▸ | ATM | Q13315 | 1/20 | 0.51 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.51 |
| ▸ | CA2 | P00918 | 3/20 | 0.50 |
| ▸ | CA12 | O43570 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA9 | Q16790 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | REN | P00797 | 1/20 | 0.47 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL28353211 | 1.00 | LMNA (0.52) | LMNACTSLCTSBCTSSCTSK | |
| SCHEMBL21877878 | 0.92 | CAPN1 (0.49) | LMNACTSLCTSBCTSSCTSK | |
| SCHEMBL21877879 | 0.92 | CAPN1 (0.49) | LMNACTSLCTSBCTSSCTSK | |
| SCHEMBL24096321 | 0.88 | CA2 (0.51) | LMNACA2CA12CA1CA9 | |
| SCHEMBL30690975 | 0.88 | CA2 (0.51) | LMNACA2CA12CA1CA9 | |
| SCHEMBL10868779 | 0.86 | REN (0.53) | REN | |
| SCHEMBL10868786 | 0.86 | REN (0.53) | REN | |
| SCHEMBL8381584 | 0.85 | CA2 (0.64) | LMNACTSSCTSKCA2CA12 | |
| SCHEMBL7517184 | 0.85 | CTSS (0.53) | LMNACTSLCTSBCTSSCTSK | |
| SCHEMBL10703886 | 0.82 | CTSK (0.61) | CTSLCTSBCTSSCTSKCAPN1 |
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-3612532-B1 | VMAT2 INHIBITOR COMPOUNDS AND COMPOSITIONS THEREOF | NEUROCRINE BIOSCIENCES INC (US) | 2023-12-13 | — | — | EP | disclosed |