Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | CASP1 | P29466 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| Cyclohexane SCHEMBL28402579 | 0.94 | TSHR (0.60) | TSHRCASP1ALDH1A1 | |
| Cyclohexane SCHEMBL29019615 | 0.94 | TSHR (0.60) | TSHRCASP1ALDH1A1 | |
| Cyclohexane SCHEMBL27772263 | 0.94 | TSHR (0.60) | TSHRCASP1ALDH1A1 | |
| Cyclohexane SCHEMBL6748666 | 0.91 | TSHR (0.56) | TSHRCASP1ALDH1A1 | |
| Cyclohexane SCHEMBL28977553 | 0.91 | TSHR (0.56) | TSHRCASP1ALDH1A1 | |
| Cyclohexane SCHEMBL3761116 | 0.84 | TSHR (0.75) | TSHRCASP1ALDH1A1 | |
| Cyclohexane SCHEMBL28947641 | 0.84 | TSHR (0.75) | TSHRCASP1ALDH1A1 | |
| Cyclopropane SCHEMBL28687940 | 0.84 | — | — | |
| SCHEMBL28561152 | 0.84 | TSHR (0.75) | TSHRCASP1ALDH1A1 | |
| SCHEMBL28690518 | 0.84 | TSHR (0.75) | TSHRCASP1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4344873-A | Potting medium from polyurethanes | AKZO NV (NL) | 1982-08-17 | — | — | US | disclosed |