Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CAPN1 | P07384 | 5/20 | 0.38 |
| ▸ | CA1 | P00915 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | LARS1 | Q9P2J5 | 1/20 | 0.37 |
| ▸ | CAPNS1 | P04632 | 1/20 | 0.35 |
| ▸ | CA4 | P22748 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | CTSL | P07711 | 1/20 | 0.35 |
| ▸ | CTSS | P25774 | 1/20 | 0.35 |
| ▸ | CTSK | P43235 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8404245 | 0.90 | CAPN1 (0.42) | CAPN1CA1CA2SMN1; SMN2CA7 | |
| SCHEMBL8811338 | 0.89 | CA1 (0.39) | CAPN1CA1CA2SMN1; SMN2CA7 | |
| SCHEMBL8406506 | 0.88 | CA1 (0.39) | CAPN1CA1CA2SMN1; SMN2CA7 | |
| SCHEMBL8808803 | 0.86 | CA1 (0.42) | CAPN1CA1CA2SMN1; SMN2CA7 | |
| SCHEMBL8813441 | 0.86 | CAPN1 (0.46) | CAPN1CAPNS1CTSLCTSSCTSK | |
| SCHEMBL8813422 | 0.86 | CAPN1 (0.46) | CAPN1CAPNS1CTSLCTSSCTSK | |
| SCHEMBL8810086 | 0.83 | CA2 (0.47) | CAPN1CA1CA2CA7CAPNS1 | |
| SCHEMBL8407579 | 0.83 | CAPN1 (0.47) | CAPN1CA1CA2SMN1; SMN2CA7 | |
| SCHEMBL8564652 | 0.83 | CAPN1 (0.47) | CAPN1CA1CA2SMN1; SMN2CA7 | |
| SCHEMBL8406510 | 0.82 | MMP2 (0.38) | CAPN1CA1CA2CA7CAPNS1 |
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-0810221-A1 | OXYGEN-CONTAINING HETEROCYCLIC DERIVATIVES | MITSUBISHI CHEMICAL CORPORATION (JP) | 1997-12-03 | — | — | EP | disclosed |