Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FDPS | P14324 | 10/20 | 0.48 |
| ▸ | SMPD1 | P17405 | 4/20 | 0.48 |
| ▸ | GGPS1 | O95749 | 6/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL12135459 | 1.00 | FDPS (0.48) | FDPSSMPD1GGPS1 | |
| Ammonia Solution, Strong SCHEMBL28504683 | 0.98 | FDPS (0.47) | FDPSSMPD1GGPS1 | |
| SCHEMBL1199963 | 0.97 | FDPS (0.46) | FDPSSMPD1GGPS1 | |
| SCHEMBL6151052 | 0.90 | — | — | |
| SCHEMBL1271337 | 0.90 | FDPS (0.52) | FDPSSMPD1GGPS1 | |
| SCHEMBL5391830 | 0.90 | FDPS (0.52) | FDPSSMPD1GGPS1 | |
| SCHEMBL7719887 | 0.85 | FDPS (0.48) | FDPSSMPD1GGPS1 | |
| SCHEMBL999922 | 0.84 | FDPS (0.48) | FDPSSMPD1GGPS1 | |
| SCHEMBL18808043 | 0.84 | FDPS (0.32) | FDPSSMPD1 | |
| Methacrylic Acid SCHEMBL28674043 | 0.83 | FDPS (0.41) | FDPSSMPD1GGPS1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3327603-B1 | METHOD AND DEVICE FOR CALCULATING ACID DISSOCIATION CONSTANT, AND PROGRAM | FUJITSU LTD (JP) | 2021-08-11 | — | — | EP | disclosed |
| EP-3327603-A1 | METHOD AND DEVICE FOR CALCULATING ACID DISSOCIATION CONSTANT, AND PROGRAM | Fujitsu Limited (JP) | 2018-05-30 | — | — | EP | disclosed |