Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LPAR1 | Q92633 | 1/20 | 0.34 |
| ▸ | LPAR2 | Q9HBW0 | 1/20 | 0.34 |
| ▸ | LPAR3 | Q9UBY5 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 2/20 | 0.33 |
| ▸ | CA1 | P00915 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 2/20 | 0.33 |
| ▸ | CA9 | Q16790 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 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 | |
|---|---|---|---|---|
| SCHEMBL7942943 | 1.00 | LPAR1 (0.34) | LPAR1LPAR2LPAR3THRBCA1 | |
| SCHEMBL14939429 | 0.98 | THRB (0.38) | LPAR1LPAR2LPAR3THRBCA1 | |
| SCHEMBL489185 | 0.98 | THRB (0.38) | LPAR1LPAR2LPAR3THRBCA1 | |
| SCHEMBL905315 | 0.98 | THRB (0.38) | LPAR1LPAR2LPAR3THRBCA1 | |
| SCHEMBL14939723 | 0.98 | THRB (0.38) | LPAR1LPAR2LPAR3THRBCA1 | |
| SCHEMBL14939428 | 0.98 | THRB (0.38) | LPAR1LPAR2LPAR3THRBCA1 | |
| SCHEMBL14939724 | 0.98 | THRB (0.38) | LPAR1LPAR2LPAR3THRBCA1 | |
| SCHEMBL9997345 | 0.98 | THRB (0.38) | LPAR1LPAR2LPAR3THRBCA1 | |
| SCHEMBL12197478 | 0.92 | — | — | |
| SCHEMBL723502 | 0.92 | — | — |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6175036-B1 | CATALYZING THE CARBOXYLATION OF AN ALKOXY-BUTENE WITH CARBON MONOXIDE IN THE PRESENCE OF A CATALYST SYSTEM COMPRISING PALLADIUM, A PHOSPHORUS LIGAND AND AN ACID PROMOTOR | DSM N.V. (NL) | 2001-01-16 | — | — | US | claimed |
| EP-0975574-A1 | PROCESS TO PREPARE A PENTENOIC ACID DERIVATIVE | DSM N.V. (NL) | 2000-02-02 | — | — | EP | claimed |
| WO-1998038151-A1 | PROCESS TO PREPARE A PENTENOIC ACID DERIVATIVE | DSM N.V. (NL) | 1998-09-03 | — | — | WO | claimed |
| US-6175036-B1 | CATALYZING THE CARBOXYLATION OF AN ALKOXY-BUTENE WITH CARBON MONOXIDE IN THE PRESENCE OF A CATALYST SYSTEM COMPRISING PALLADIUM, A PHOSPHORUS LIGAND AND AN ACID PROMOTOR | DSM N.V. (NL) | 2001-01-16 | — | — | US | disclosed |
| US-6175036-B1 | CATALYZING THE CARBOXYLATION OF AN ALKOXY-BUTENE WITH CARBON MONOXIDE IN THE PRESENCE OF A CATALYST SYSTEM COMPRISING PALLADIUM, A PHOSPHORUS LIGAND AND AN ACID PROMOTOR | DSM N.V. (NL) | 2001-01-16 | — | — | US | disclosed |
| CN-1252786-A | Process to prepare a pentenoic acid derivative | DSM NV (NL) | 2000-05-10 | — | — | CN | disclosed |
| EP-0975574-A1 | PROCESS TO PREPARE A PENTENOIC ACID DERIVATIVE | DSM N.V. (NL) | 2000-02-02 | — | — | EP | disclosed |
| EP-0975574-A1 | PROCESS TO PREPARE A PENTENOIC ACID DERIVATIVE | DSM N.V. (NL) | 2000-02-02 | — | — | EP | disclosed |
| WO-1998038151-A1 | PROCESS TO PREPARE A PENTENOIC ACID DERIVATIVE | DSM N.V. (NL) | 1998-09-03 | — | — | WO | disclosed |
| WO-1998038151-A1 | PROCESS TO PREPARE A PENTENOIC ACID DERIVATIVE | DSM N.V. (NL) | 1998-09-03 | — | — | WO | disclosed |
| CN-1104630-A | Process for producing 1,4-dicyano-2-butene | SUMITOMO CHEMICAL CO (JP) | 1995-07-05 | — | — | CN | disclosed |