Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CAPN1 | P07384 | 3/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CTSK | P43235 | 6/20 | 0.45 |
| ▸ | SYK | P43405 | 1/20 | 0.44 |
| ▸ | CTRB1 | P17538 | 2/20 | 0.43 |
| ▸ | CASP1 | P29466 | 2/20 | 0.42 |
| ▸ | CASP3 | P42574 | 2/20 | 0.42 |
| ▸ | CASP7 | P55210 | 2/20 | 0.42 |
| ▸ | CASP6 | P55212 | 2/20 | 0.42 |
| ▸ | CASP8 | Q14790 | 2/20 | 0.42 |
| ▸ | CTSL | P07711 | 2/20 | 0.42 |
| ▸ | CTSS | P25774 | 2/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8404287 | 0.89 | CAPN1 (0.51) | CAPN1CYP1A2CTSKCASP1CASP3 | |
| SCHEMBL8810057 | 0.83 | CAPN1 (0.47) | CAPN1CYP1A2CTSKCASP1CASP3 | |
| SCHEMBL8808396 | 0.82 | CTSK (0.54) | CAPN1CTSKCTSLCTSS | |
| SCHEMBL8808408 | 0.82 | CTSK (0.54) | CAPN1CTSKCTSLCTSS | |
| SCHEMBL8407710 | 0.80 | CAPN1 (0.47) | CAPN1CYP1A2CTSKCASP1CASP3 | |
| SCHEMBL8811002 | 0.79 | CAPN1 (0.48) | CAPN1CTSKCASP1CASP3CASP7 | |
| SCHEMBL8808872 | 0.79 | CTSK (0.43) | CAPN1CYP1A2CTSKCASP1CASP3 | |
| SCHEMBL8809745 | 0.78 | CAPN1 (0.50) | CAPN1CTSKCASP1CASP3CASP7 | |
| SCHEMBL8810223 | 0.78 | CTSL (0.58) | CAPN1CTSKCTSLCTSS | |
| SCHEMBL8810216 | 0.78 | CTSL (0.58) | CAPN1CTSKCTSLCTSS |
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 |