Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | KIF11 | P52732 | 5/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 3/20 | 0.35 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.33 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.32 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.32 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.32 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.32 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.32 |
| ▸ | CYP2A13 | Q16696 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL12807493 | 0.80 | ADRA2A (0.40) | SLC6A3HTR2CADRA2AADRA1AADRA2B | |
| SCHEMBL413037 | 0.79 | ADRA2A (0.49) | MEN1KMT2ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL8179283 | 0.78 | UGT2B17 (0.42) | KDM4EMEN1ALOX15KMT2AHSD17B10 | |
| SCHEMBL835462 | 0.77 | ADRA1A (0.52) | MEN1KMT2AHTR2CADRA2AADRA1A | |
| SCHEMBL14450169 | 0.77 | AR (0.38) | KDM4EALDH1A1 | |
| SCHEMBL14345575 | 0.74 | DDB1 (0.37) | KDM4EHSD17B10KDM4CALDH1A1TSHR | |
| SCHEMBL15800566 | 0.71 | HRH3 (0.39) | KDM4EMEN1ALOX15KMT2AHSD17B10 | |
| SCHEMBL598145 | 0.69 | ADRA2A (0.44) | MEN1KMT2ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL1660824 | 0.69 | DRD2 (0.50) | CYP2A6CYP2A13 | |
| SCHEMBL22143868 | 0.69 | DRD2 (0.44) | HTR2CKDM4C |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8895789-B2 | Fuel composition for use in gasoline engines | SHELL OIL COMPANY (US) | 2014-11-25 | — | — | US | claimed |
| US-8895789-B2 | Fuel composition for use in gasoline engines | SHELL OIL COMPANY (US) | 2014-11-25 | — | — | US | disclosed |
| US-8876920-B2 | Fuel composition for use in gasoline engines | SHELL OIL COMPANY (US) | 2014-11-04 | — | — | US | disclosed |
| EP-2367907-B1 | FUEL COMPOSITION FOR USE IN GASOLINE ENGINES | SHELL INT RESEARCH (NL) | 2013-04-24 | — | — | EP | disclosed |
| EP-2367908-B1 | FUEL COMPOSITION FOR USE IN GASOLINE ENGINES | SHELL INT RESEARCH (NL) | 2013-02-20 | — | — | EP | disclosed |
| US-20120101316-A1 | METHOD FOR THE PREPARATION OF A FUEL COMPOSITION FOR USE IN GASOLINE ENGINES AND BLENDING COMPONENT | SHELL OIL COMPANY | 2012-04-26 | — | — | US | disclosed |
| US-20120022304-A1 | FUEL COMPOSITION FOR USE IN GASOLINE ENGINES | SHELL OIL COMPANY (US) | 2012-01-26 | — | — | US | disclosed |
| EP-2367908-A1 | FUEL COMPOSITION FOR USE IN GASOLINE ENGINES | Shell Internationale Research Maatschappij B.V. (NL) | 2011-09-28 | — | — | EP | disclosed |
| EP-2367907-A1 | FUEL COMPOSITION FOR USE IN GASOLINE ENGINES | Shell Internationale Research Maatschappij B.V. (NL) | 2011-09-28 | — | — | EP | disclosed |
| EP-2367906-A1 | METHOD FOR THE PREPARATION OF A FUEL COMPOSITION FOR USE IN GASOLINE ENGINES AND BLENDING COMPONENT | Shell Internationale Research Maatschappij B.V. (NL) | 2011-09-28 | — | — | EP | disclosed |
| WO-2010066879-A1 | FUEL COMPOSITION FOR USE IN GASOLINE ENGINES | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 2010-06-17 | — | — | WO | disclosed |
| WO-2010066876-A1 | FUEL COMPOSITION FOR USE IN GASOLINE ENGINES | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 2010-06-17 | — | — | WO | disclosed |
| WO-2010066881-A1 | METHOD FOR THE PREPARATION OF A FUEL COMPOSITION FOR USE IN GASOLINE ENGINES AND BLENDING COMPONENT | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 2010-06-17 | — | — | WO | disclosed |