Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.71 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.71 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | CES1 | P23141 | 6/20 | 0.48 |
| ▸ | CES2 | O00748 | 10/20 | 0.47 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | FFAR3 | O14843 | 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 | |
|---|---|---|---|---|
| Butanone SCHEMBL11812300 | 0.94 | ALDH1A1 (0.62) | ALDH1A1TDP1LMNATSHRCES1 | |
| Hexane SCHEMBL2937805 | 0.93 | ALDH1A1 (0.71) | ALDH1A1TDP1TSHRCES1CES2 | |
| Octane SCHEMBL5026156 | 0.90 | ALDH1A1 (0.67) | ALDH1A1TDP1TSHRCES1CES2 | |
| Heptane SCHEMBL1420888 | 0.90 | ALDH1A1 (0.67) | ALDH1A1TDP1TSHRCES1CES2 | |
| Hexane SCHEMBL28612680 | 0.87 | ALDH1A1 (0.62) | ALDH1A1TDP1LMNATSHRCES1 | |
| Pentane SCHEMBL8024731 | 0.85 | TSHR (0.58) | ALDH1A1TDP1LMNATSHRCES1 | |
| Pentane SCHEMBL8034549 | 0.85 | TSHR (0.58) | ALDH1A1TDP1LMNATSHRCES1 | |
| Pentane SCHEMBL9326249 | 0.85 | TSHR (0.58) | ALDH1A1TDP1LMNATSHRCES1 | |
| Butanone SCHEMBL10380765 | 0.85 | — | — | |
| Pentane SCHEMBL714047 | 0.85 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114369882-A | Self-coloring graphene fiber and preparation method and application thereof | 江苏省特种设备安全监督检验研究院 | 2022-04-19 | — | — | CN | disclosed |
| CN-110088239-B | Haze free base oil fraction derived from a fischer-tropsch feedstock | 国际壳牌研究有限公司 | 2022-04-05 | — | — | CN | disclosed |
| US-10934496-B2 | Fischer-tropsch feedstock derived haze-free base oil fractions | SHELL OIL COMPANY (US) | 2021-03-02 | — | — | US | disclosed |
| EP-3559158-A1 | FISCHER-TROPSCH FEEDSTOCK DERIVED HAZE-FREE BASE OIL FRACTIONS | Shell Internationale Research Maatschappij B.V. (NL) | 2019-10-30 | — | — | EP | disclosed |
| WO-2018115284-A1 | FISCHER-TROPSCH FEEDSTOCK DERIVED HAZE-FREE BASE OIL FRACTIONS | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 2018-06-28 | — | — | WO | disclosed |