Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.57 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.57 |
| ▸ | ESR1 | P03372 | 9/20 | 0.55 |
| ▸ | ESR2 | Q92731 | 9/20 | 0.55 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.44 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.42 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.41 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.41 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7703745 | 0.91 | TAAR1 (0.43) | TAAR1SLC6A2ESR1ESR2SIGMAR1 | |
| SCHEMBL28360503 | 0.84 | TAAR1 (0.59) | TAAR1SLC6A2ESR1ESR2SLC7A5 | |
| SCHEMBL9175395 | 0.84 | SRR (0.42) | TAAR1SLC6A2ESR1ADRB3 | |
| SCHEMBL9898783 | 0.83 | TRPA1 (0.38) | TAAR1SLC6A2ESR1ESR2SIGMAR1 | |
| SCHEMBL1840026 | 0.83 | TAAR1 (0.57) | TAAR1SLC6A2ESR1ESR2SLC7A5 | |
| SCHEMBL9771947 | 0.82 | TAAR1 (0.54) | TAAR1SLC6A2SIGMAR1 | |
| SCHEMBL9492753 | 0.81 | IDO1 (0.48) | ESR1ESR2ADRB3IDO1 | |
| SCHEMBL13457372 | 0.79 | TAAR1 (0.53) | TAAR1SLC6A2ESR1ESR2SLC7A5 | |
| SCHEMBL9899581 | 0.79 | SIGMAR1 (0.46) | SIGMAR1 | |
| SCHEMBL1840449 | 0.79 | TAAR1 (0.53) | TAAR1SLC6A2ESR1ESR2SLC7A5 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0327361-B1 | 3-(2-HYDROPEROXY-2-PROPYL)PHENOL AND METHOD OF PRODUCING RESORCINOL USING THE SAME | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1993-03-17 | — | — | EP | disclosed |
| US-5068455-A | Oxidation of 3-(2-hydroxy-2-propyl)phenol or m-isopropenylphenol to form hydroperoxide | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1991-11-26 | — | — | US | disclosed |
| US-5030767-A | Decomposition, solvent, inorganic acid or arenesulfonic acid as catalyst | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1991-07-09 | — | — | US | disclosed |
| EP-0327361-A1 | 3-(2-hydroperoxy-2-propyl)phenol and method of producing resorcinol using the same | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1989-08-09 | — | — | EP | disclosed |