Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.48 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LSS | P48449 | 2/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.37 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.35 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.35 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.35 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.35 |
| ▸ | NAAA | Q02083 | 1/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL8675190 | 1.00 | CYP1A2 (0.48) | CYP1A2EPHX1ALDH1A1LSSSIGMAR1 | |
| SCHEMBL27969229 | 1.00 | CYP1A2 (0.48) | CYP1A2EPHX1ALDH1A1LSSSIGMAR1 | |
| SCHEMBL29631506 | 1.00 | CYP1A2 (0.48) | CYP1A2EPHX1ALDH1A1LSSSIGMAR1 | |
| SCHEMBL30496999 | 1.00 | CYP1A2 (0.48) | CYP1A2EPHX1ALDH1A1LSSSIGMAR1 | |
| SCHEMBL5148892 | 1.00 | CYP1A2 (0.48) | CYP1A2EPHX1ALDH1A1LSSSIGMAR1 | |
| SCHEMBL30497001 | 1.00 | CYP1A2 (0.48) | CYP1A2EPHX1ALDH1A1LSSSIGMAR1 | |
| SCHEMBL27442079 | 0.98 | CYP1A2 (0.50) | CYP1A2EPHX1ALDH1A1LSSSIGMAR1 | |
| SCHEMBL626521 | 0.92 | CYP1A2 (0.58) | CYP1A2EPHX1SIGMAR1HTTLMNA | |
| Water SCHEMBL27358128 | 0.90 | CYP1A2 (0.56) | CYP1A2SIGMAR1HTTLMNAMAPK1 | |
| SCHEMBL21360671 | 0.88 | CYP1A2 (0.41) | CYP1A2ALDH1A1NAAAHTTMAPK1 |
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-115400799-B | Fuel additive, preparation method thereof and hydrocarbon fuel nanofluid | 天津大学 | 2023-08-01 | — | — | CN | disclosed |