Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCKBR | P32239 | 8/20 | 0.68 |
| ▸ | CCKAR | P32238 | 5/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.60 |
| ▸ | MAPT | P10636 | 1/20 | 0.60 |
| ▸ | TSHR | P16473 | 1/20 | 0.60 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL8973306 | 1.00 | CCKBR (0.68) | CCKBRCCKARCYP3A4MAPTTSHR | |
| SCHEMBL8534720 | 0.88 | CCKBR (0.82) | CCKBRCCKARCYP3A4MAPTTSHR | |
| SCHEMBL8774345 | 0.88 | CCKBR (0.82) | CCKBRCCKARCYP3A4MAPTTSHR | |
| SCHEMBL9057111 | 0.83 | CCKBR (0.71) | CCKBRCCKARCYP3A4MAPTTSHR | |
| SCHEMBL8533798 | 0.83 | CCKBR (0.78) | CCKBRCCKARCYP3A4MAPTTSHR | |
| SCHEMBL8538375 | 0.83 | CCKBR (0.71) | CCKBRCCKAR | |
| SCHEMBL8538152 | 0.83 | CCKBR (0.71) | CCKBRCCKARCYP3A4MAPTTSHR | |
| SCHEMBL9120535 | 0.83 | CCKBR (0.68) | CCKBRCCKARCYP3A4MAPTTSHR | |
| SCHEMBL8774271 | 0.82 | CCKBR (0.69) | CCKBRCCKARCYP3A4MAPTTSHR | |
| SCHEMBL8775098 | 0.82 | CCKBR (0.69) | CCKBRCCKARKCNH2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-8073444-A | — | — | None | — | — | JP | disclosed |
| JP-H0873444-A | BENZODIAZEPINE DERIVATIVE | FUJISAWA PHARMACEUT CO LTD | 1996-03-19 | — | — | JP | disclosed |