Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 8/20 | 0.43 |
| ▸ | CA2 | P00918 | 8/20 | 0.43 |
| ▸ | CA9 | Q16790 | 7/20 | 0.43 |
| ▸ | LPAR3 | Q9UBY5 | 3/20 | 0.43 |
| ▸ | CA12 | O43570 | 3/20 | 0.43 |
| ▸ | CA7 | P43166 | 3/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.43 |
| ▸ | LPAR1 | Q92633 | 2/20 | 0.43 |
| ▸ | LPAR2 | Q9HBW0 | 2/20 | 0.43 |
| ▸ | CA3 | P07451 | 2/20 | 0.43 |
| ▸ | CA4 | P22748 | 2/20 | 0.43 |
| ▸ | CA6 | P23280 | 2/20 | 0.43 |
| ▸ | CA5A | P35218 | 2/20 | 0.43 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.43 |
| ▸ | NAAA | Q02083 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 2/20 | 0.41 |
| ▸ | CES2 | O00748 | 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 | |
|---|---|---|---|---|
| SCHEMBL11228547 | 1.00 | CA1 (0.43) | CA1CA2CA9LPAR3CA12 | |
| SCHEMBL326032 | 1.00 | CA1 (0.43) | CA1CA2CA9LPAR3CA12 | |
| SCHEMBL325034 | 1.00 | CA1 (0.43) | CA1CA2CA9LPAR3CA12 | |
| SCHEMBL2905921 | 1.00 | CA1 (0.43) | CA1CA2CA9LPAR3CA12 | |
| SCHEMBL324701 | 1.00 | CA1 (0.43) | CA1CA2CA9LPAR3CA12 | |
| SCHEMBL273331 | 1.00 | CA1 (0.43) | CA1CA2CA9LPAR3CA12 | |
| SCHEMBL11232265 | 1.00 | CA1 (0.43) | CA1CA2CA9LPAR3CA12 | |
| Hexadecane SCHEMBL8507253 | 1.00 | CA1 (0.43) | CA1CA2CA9LPAR3CA12 | |
| SCHEMBL36625 | 1.00 | CA1 (0.43) | CA1CA2CA9LPAR3CA12 | |
| SCHEMBL1774886 | 1.00 | CA1 (0.43) | CA1CA2CA9LPAR3CA12 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4365973-A | Middle distillate fuel additive | UNION OIL COMPANY OF CALIFORNIA (US) | 1982-12-28 | — | — | US | claimed |
| WO-2013093100-A1 | ORGANIC NITRATES AS IGNITION ENHANCERS | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 2013-06-27 | — | — | WO | disclosed |
| US-20130160354-A1 | ORGANIC NITRATES AS IGNITION ENHANCERS | SHELL OIL COMPANY (US) | 2013-06-27 | — | — | US | disclosed |
| US-20130160354-A1 | ORGANIC NITRATES AS IGNITION ENHANCERS | SHELL OIL COMPANY (US) | 2013-06-27 | — | — | US | disclosed |
| WO-1993008244-A1 | FUEL OIL COMPOSITIONS | EXXON CHEMICAL PATENTS INC. (US) | 1993-04-29 | — | — | WO | disclosed |
| US-4365973-A | Middle distillate fuel additive | UNION OIL COMPANY OF CALIFORNIA (US) | 1982-12-28 | — | — | US | disclosed |
| US-4310500-A | Method for removing volatile aromatic compounds | JOSEF MEISSNER GMBH & CO. (DE) | 1982-01-12 | — | — | US | disclosed |