Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CAPN1 | P07384 | 4/20 | 0.43 |
| ▸ | CAPNS1 | P04632 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | CTSS | P25774 | 3/20 | 0.36 |
| ▸ | CTSK | P43235 | 5/20 | 0.36 |
| ▸ | CTSL | P07711 | 2/20 | 0.36 |
| ▸ | KEAP1 | Q14145 | 2/20 | 0.36 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.36 |
| ▸ | CTSB | P07858 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.36 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.36 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.36 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8406495 | 0.88 | CAPN1 (0.51) | CAPN1CAPNS1CYP1A2CTSSCTSK | |
| SCHEMBL8407723 | 0.87 | CYP1A2 (0.43) | CAPN1CAPNS1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL8808894 | 0.85 | CAPN1 (0.56) | CAPN1CAPNS1CTSSCTSKCTSL | |
| SCHEMBL8808915 | 0.85 | CAPN1 (0.56) | CAPN1CAPNS1CTSSCTSKCTSL | |
| SCHEMBL8811439 | 0.83 | CAPN1 (0.44) | CAPN1CAPNS1CYP1A2CTSSCTSK | |
| SCHEMBL8807949 | 0.82 | CAPN1 (0.42) | CAPN1CAPNS1CASP3KMT2A | |
| SCHEMBL8404222 | 0.78 | CAPN1 (0.47) | CAPN1CAPNS1RAB9APSMB1PSMB5 | |
| SCHEMBL8810857 | 0.78 | CAPN1 (0.49) | CAPN1CAPNS1CYP1A2CASP3 | |
| SCHEMBL8808948 | 0.77 | CAPN1 (0.44) | CAPN1CAPNS1MAPTRAB9A | |
| SCHEMBL8407947 | 0.76 | CAPN1 (0.44) | CAPN1CAPNS1MAPTRAB9AMEN1 |
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 |