Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 6/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11242612 | 0.93 | TSHR (0.40) | TSHRHPGDALDH1A1THRB | |
| SCHEMBL21084615 | 0.92 | TSHR (0.34) | TSHRHPGDALDH1A1 | |
| Butadiene SCHEMBL3005398 | 0.88 | ALDH1A1 (0.39) | TSHRALDH1A1THRB | |
| SCHEMBL26503 | 0.88 | TSHR (0.44) | TSHRHPGDALDH1A1THRB | |
| SCHEMBL14871 | 0.88 | ALDH1A1 (0.44) | TSHRALDH1A1THRB | |
| Acrylic Acid SCHEMBL28509034 | 0.87 | ALDH1A1 (0.35) | TSHRALDH1A1THRB | |
| SCHEMBL6250404 | 0.87 | TSHR (0.35) | TSHRHPGDALDH1A1THRB | |
| SCHEMBL27143080 | 0.86 | TSHR (0.42) | TSHRHPGDALDH1A1THRB | |
| SCHEMBL10879521 | 0.84 | TSHR (0.43) | TSHRHPGDALDH1A1THRB | |
| SCHEMBL3401710 | 0.83 | TSHR (0.38) | TSHRHPGDALDH1A1THRB |
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-4981921-A | LACTONE MODIFIED ACRYLATE | BAYER AKTIENGESELLSCHAFT (DE) | 1991-01-01 | — | — | US | claimed |