Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMPD1 | P17405 | 4/20 | 0.37 |
| ▸ | FDPS | P14324 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 3/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.31 |
| ▸ | GGPS1 | O95749 | 1/20 | 0.31 |
| ▸ | DNM1 | Q05193 | 4/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL27669915 | 0.98 | TSHR (0.36) | SMPD1FDPSTSHROPRM1 | |
| SCHEMBL20457455 | 0.78 | TSHR (0.36) | SMPD1FDPSTSHRTHRBGGPS1 | |
| SCHEMBL25276792 | 0.76 | SMPD1 (0.43) | SMPD1FDPSTSHROPRM1THRB | |
| SCHEMBL25270758 | 0.76 | SMPD1 (0.43) | SMPD1FDPSTSHROPRM1THRB | |
| SCHEMBL24515074 | 0.76 | TSHR (0.34) | FDPSTSHRTHRBGGPS1 | |
| SCHEMBL7718828 | 0.74 | OPRM1 (0.42) | SMPD1FDPSTSHROPRM1THRB | |
| SCHEMBL4632058 | 0.74 | OPRM1 (0.42) | SMPD1FDPSTSHROPRM1THRB | |
| SCHEMBL5791123 | 0.74 | OPRM1 (0.42) | SMPD1FDPSTSHROPRM1THRB | |
| SCHEMBL28732851 | 0.73 | FDPS (0.41) | SMPD1FDPSTSHROPRM1THRB | |
| SCHEMBL11521706 | 0.72 | SMPD1 (0.43) | SMPD1FDPSTSHROPRM1THRB |
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-0162413-A2 | Polyamine for use as a medicine in the treatment of neoplasms | MERRELL DOW PHARMACEUTICALS INC. (US) | 1985-11-27 | — | — | EP | disclosed |