Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | KCNN4 | O15554 | 3/20 | 0.35 |
| ▸ | ESR1 | P03372 | 2/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11047013 | 0.79 | TSHR (0.46) | TSHRTAAR1MAPK1CYP2C19HIF1A | |
| SCHEMBL9250206 | 0.79 | TAAR1 (0.54) | TSHRTAAR1MAPK1CYP2C19HIF1A | |
| SCHEMBL11199750 | 0.78 | KIF11 (0.38) | CYP2C19CYP1A2CYP3A4 | |
| SCHEMBL11045361 | 0.76 | CYP2C19 (0.43) | TSHRTAAR1MAPK1CYP2C19HIF1A | |
| SCHEMBL7938667 | 0.73 | TAAR1 (0.46) | TSHRTAAR1MAPK1CYP2C19HIF1A | |
| SCHEMBL2239057 | 0.73 | TAAR1 (0.46) | TSHRTAAR1MAPK1CYP2C19HIF1A | |
| SCHEMBL2701561 | 0.72 | TSHR (0.55) | TSHRTAAR1MAPK1CYP2C19HIF1A | |
| SCHEMBL2870418 | 0.71 | CYP2C19 (0.45) | TSHRTAAR1MAPK1CYP2C19HIF1A | |
| SCHEMBL9418622 | 0.71 | TSHR (0.35) | TSHR | |
| SCHEMBL10778628 | 0.70 | TAAR1 (0.54) | TSHRTAAR1MAPK1CYP2C19HIF1A |
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-4486612-A | Method of preparing tertiary carbinols | THE DOW CHEMICAL COMPANY (US) | 1984-12-04 | — | — | US | claimed |