Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.58 |
| ▸ | CES1 | P23141 | 1/20 | 0.58 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.50 |
| ▸ | POLB | P06746 | 6/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.50 |
| ▸ | MEN1 | O00255 | 3/20 | 0.50 |
| ▸ | RECQL | P46063 | 2/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | THRB | P10828 | 1/20 | 0.50 |
| ▸ | APEX1 | P27695 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 4/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.48 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.48 |
| ▸ | FEN1 | P39748 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL109405 | 0.93 | — | — | |
| Hydrochloric Acid SCHEMBL4129676 | 0.91 | — | — | |
| SCHEMBL27292956 | 0.91 | — | — | |
| SCHEMBL8051726 | 0.85 | CES2 (0.56) | CES2CES1PTPN1ALDH1A1POLB | |
| Furfural SCHEMBL28541665 | 0.79 | ALDH1A1 (0.64) | CES2CES1PTPN1ALDH1A1POLB | |
| SCHEMBL1180379 | 0.78 | — | — | |
| SCHEMBL24446 | 0.77 | — | — | |
| SCHEMBL3811314 | 0.77 | CES2 (0.68) | CES2CES1PTPN1ALDH1A1POLB | |
| SCHEMBL1553449 | 0.76 | CES2 (0.74) | CES2CES1PTPN1ALDH1A1POLB | |
| SCHEMBL1933054 | 0.75 | CES2 (0.59) | CES2CES1PTPN1ALDH1A1POLB |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0795596-B1 | Fuel compositions | SHELL INT RESEARCH (NL) | 2000-10-11 | — | — | EP | disclosed |
| US-5925152-A | MIXTURE CONTAINING A FUEL ADDITIVE FURAN DERIVATIVE HAVING HETEROCYCLIC AND/OR ARYL CARBOCYCLIC GROUPS; ANTIDEPOSIT AGENTS, ANTIKNOCK COMPOUNDS | SHELL OIL COMPANY (US) | 1999-07-20 | — | — | US | disclosed |
| EP-0795596-A1 | Fuel compositions | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1997-09-17 | — | — | EP | disclosed |