Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 5/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.34 |
| ▸ | AR | P10275 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Orthocresol SCHEMBL8064441 | 0.80 | TRPA1 (0.50) | TRPA1CYP2C19CYP1A2ATMTSHR | |
| Orthocresol SCHEMBL27576819 | 0.80 | TRPA1 (0.50) | TRPA1CYP2C19CYP1A2ATMTSHR | |
| Phenol SCHEMBL4386880 | 0.79 | TDP1 (0.46) | CYP2C19CYP1A2AOC3SLC6A2SLC6A3 | |
| Orthocresol SCHEMBL27887877 | 0.78 | TRPA1 (0.44) | TRPA1CYP2C19CYP1A2ATMTSHR | |
| Orthocresol SCHEMBL11426298 | 0.78 | TRPA1 (0.48) | TRPA1CYP2C19CYP1A2ATMTSHR | |
| SCHEMBL9438463 | 0.77 | TSHR (0.38) | TRPA1ATMTSHRESR1ALDH1A1 | |
| Orthocresol SCHEMBL27670622 | 0.77 | TRPA1 (0.52) | TRPA1CYP2C19CYP1A2ATMTSHR | |
| Orthocresol SCHEMBL27373848 | 0.76 | ESR1 (0.47) | TRPA1CYP2C19CYP1A2ATMTSHR | |
| Orthocresol SCHEMBL4619176 | 0.75 | TRPA1 (0.50) | TRPA1CYP2C19CYP1A2ATMTSHR | |
| Orthocresol SCHEMBL29060427 | 0.75 | TRPA1 (0.50) | TRPA1CYP2C19CYP1A2ATMTSHR |
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-20020082199-A1 | Insoluble insulin compositions | BRADER MARK LAURENCE (US) | 2002-06-27 | — | — | US | disclosed |