Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.70 |
| ▸ | LTA4H | P09960 | 1/20 | 0.46 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | PPARG | P37231 | 1/20 | 0.42 |
| ▸ | PPARA | Q07869 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | NOS2 | P35228 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Benzyl Alcohol SCHEMBL8057636 | 0.95 | TSHR (0.78) | TSHRLTA4HTRPA1TDP1AKR1B1 | |
| Benzyl Alcohol SCHEMBL11807282 | 0.92 | TSHR (0.74) | TSHRLTA4HTRPA1TDP1AKR1B1 | |
| Benzyl Alcohol SCHEMBL4605492 | 0.89 | TSHR (0.88) | TSHRLTA4HTRPA1TDP1AKR1B1 | |
| Benzyl Alcohol SCHEMBL11137293 | 0.89 | TSHR (0.61) | TSHRLTA4HTRPA1AKR1B1PPARG | |
| Benzyl Alcohol SCHEMBL28108812 | 0.87 | TSHR (0.82) | TSHRLTA4HTRPA1TDP1AKR1B1 | |
| Benzyl Alcohol SCHEMBL27682363 | 0.84 | TSHR (0.78) | TSHRLTA4HTRPA1TDP1AKR1B1 | |
| Benzyl Alcohol SCHEMBL28253708 | 0.84 | TSHR (0.78) | TSHRLTA4HTRPA1TDP1AKR1B1 | |
| Benzyl Alcohol SCHEMBL20598471 | 0.84 | TSHR (0.88) | TSHRLTA4HTRPA1TDP1AKR1B1 | |
| Benzyl Alcohol SCHEMBL433990 | 0.84 | TSHR (1.00) | TSHRLTA4HTRPA1TDP1AKR1B1 | |
| Benzyl Alcohol SCHEMBL11353823 | 0.84 | TSHR (1.00) | TSHRLTA4HTRPA1TDP1AKR1B1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7794712-B2 | Production of mutant strain of Aspergillus fumigatus, method of assay for inhibiting siderophore biosynthesis and diagnostic method for detecting likely Aspergillus fumigatus infection | SIMON FRASER UNIVERSITY (CA) | 2010-09-14 | — | — | US | disclosed |
| US-20060079580-A1 | Production of mutant strain of aspergillus fumigatus, method of assay for inhibiting siderophore biosynthesis and diagnostic method for detecting likely aspergillus fumigatus infection | SIMON FRASER UNIVERSITY (CA) | 2006-04-13 | — | — | US | disclosed |