Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.42 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.42 |
| ▸ | HTR2B | P41595 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | LTA4H | P09960 | 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 | |
|---|---|---|---|---|
| Aniline SCHEMBL28280198 | 1.00 | TSHR (0.49) | TSHRALDH1A1MAPTNPC1RAB9A | |
| Aniline SCHEMBL28280194 | 0.98 | TSHR (0.46) | TSHRALDH1A1MAPTNPC1RAB9A | |
| Butyl Formate SCHEMBL28169702 | 0.93 | CYP2C9 (0.44) | TSHRALDH1A1MAPTNPC1RAB9A | |
| Aniline SCHEMBL28281247 | 0.86 | TSHR (0.42) | TSHRALDH1A1MAPTNPC1RAB9A | |
| Benzene SCHEMBL27331235 | 0.86 | HCAR2 (0.41) | TSHRALDH1A1LMNATP53 | |
| Benzene SCHEMBL28142175 | 0.86 | HCAR2 (0.41) | TSHRALDH1A1LMNATP53 | |
| Hexyl Formate SCHEMBL28202778 | 0.86 | HCAR2 (0.41) | TSHRALDH1A1LMNATP53 | |
| Phenol SCHEMBL28178475 | 0.83 | NR5A1 (0.50) | TSHRALDH1A1MAPTKDM4EPOLB | |
| Phenol SCHEMBL28074072 | 0.83 | NR5A1 (0.50) | TSHRALDH1A1MAPTKDM4EPOLB | |
| Heptyl Formate SCHEMBL28150827 | 0.83 | NR5A1 (0.50) | TSHRALDH1A1MAPTKDM4EPOLB |
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 |
|---|---|---|---|---|---|---|---|
| CN-109415553-A | The thermosetting resin of plasticising and related solidified resin, curing method and the product comprising solidified resin | 马萨诸塞大学 | 2019-03-01 | — | — | CN | claimed |