Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | THRB | P10828 | 8/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 2/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | AKR1B10 | O60218 | 2/20 | 0.45 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.45 |
| ▸ | MET | P08581 | 4/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA4 | P22748 | 1/20 | 0.43 |
| ▸ | CA6 | P23280 | 1/20 | 0.43 |
| ▸ | CA5A | P35218 | 1/20 | 0.43 |
| ▸ | CA7 | P43166 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.43 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL29067281 | 0.95 | TSHR (0.52) | TSHRALDH1A1CYP3A4THRBHPGD | |
| SCHEMBL13839915 | 0.91 | TSHR (0.49) | TSHRALDH1A1CYP3A4THRBHPGD | |
| SCHEMBL29067274 | 0.89 | MET (0.54) | TSHRALDH1A1CYP3A4THRBHPGD | |
| SCHEMBL13839913 | 0.88 | TSHR (0.46) | TSHRALDH1A1CYP3A4THRBHPGD | |
| SCHEMBL23277156 | 0.86 | TSHR (0.56) | TSHRALDH1A1CYP3A4THRBHPGD | |
| SCHEMBL13506252 | 0.86 | TSHR (0.61) | TSHRALDH1A1CYP3A4THRBHPGD | |
| SCHEMBL21242234 | 0.86 | TSHR (0.61) | TSHRALDH1A1CYP3A4THRBHPGD | |
| SCHEMBL21242530 | 0.86 | TSHR (0.61) | TSHRALDH1A1CYP3A4THRBHPGD | |
| SCHEMBL19738420 | 0.85 | AKR1B10 (0.47) | TSHRALDH1A1CYP3A4THRBHPGD | |
| SCHEMBL21242266 | 0.84 | TSHR (0.59) | TSHRALDH1A1CYP3A4THRBHPGD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002012359-A2 | MULTIPOLYMER IN AQUEOUS DISPERSION, WATER-BASED COMPOSITION AND PROCESS TO OBTAIN A MULTIPOLYMER IN AQUEOUS DISPERSION | RHODIA BRASIL LTDA. (BR) | 2002-02-14 | — | — | WO | disclosed |