Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 9/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | HCAR2 | Q8TDS4 | 3/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 2/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.33 |
| ▸ | RARB | P10826 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL1821242 | 1.00 | TSHR (0.51) | TSHRALDH1A1CYP3A4HPGDHCAR2 | |
| SCHEMBL2841941 | 0.92 | TSHR (0.43) | TSHRALDH1A1CYP3A4HPGDHCAR2 | |
| Acrylic Acid Ethyl Ester SCHEMBL7225855 | 0.89 | TSHR (0.61) | TSHRALDH1A1CYP3A4HPGDHCAR2 | |
| SCHEMBL8396140 | 0.86 | TSHR (0.45) | TSHRALDH1A1CYP3A4HPGDHCAR2 | |
| SCHEMBL25275191 | 0.85 | TSHR (0.70) | TSHRALDH1A1CYP3A4HPGDHCAR2 | |
| SCHEMBL25228041 | 0.85 | TSHR (0.70) | TSHRALDH1A1CYP3A4HPGDHCAR2 | |
| SCHEMBL7111058 | 0.85 | TSHR (0.70) | TSHRALDH1A1CYP3A4HPGDHCAR2 | |
| SCHEMBL25281286 | 0.85 | TSHR (0.70) | TSHRALDH1A1CYP3A4HPGDHCAR2 | |
| SCHEMBL20503422 | 0.85 | TSHR (0.70) | TSHRALDH1A1CYP3A4HPGDHCAR2 | |
| SCHEMBL673261 | 0.85 | TSHR (0.70) | TSHRALDH1A1CYP3A4HPGDHCAR2 |
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-4000218-A | PROCESS FOR PREPARING PARTICULATE POLYURETHANE POLYMERS AND THE POLYMERS DERIVED THEREFROM | UNION CARBIDE CORPORATION (US) | 1976-12-28 | — | — | US | disclosed |