Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.47 |
| ▸ | CES1 | P23141 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL12024336 | 0.83 | POLB (0.62) | POLBCYP2C9SMN1; SMN2EPHX1CES1 | |
| SCHEMBL343830 | 0.81 | POLB (0.65) | POLBCYP2C9SMN1; SMN2EPHX1NPC1 | |
| SCHEMBL408310 | 0.77 | CYP2C9 (0.67) | POLBCYP2C9SMN1; SMN2EPHX1NPC1 | |
| SCHEMBL118008 | 0.77 | HDAC3 (0.54) | POLBCYP2C9SMN1; SMN2EPHX1CES1 | |
| SCHEMBL4033532 | 0.76 | POLB (0.54) | POLBCYP2C9SMN1; SMN2EPHX1CES1 | |
| Acetic Acid SCHEMBL6202098 | 0.76 | POLB (0.53) | POLBCYP2C9SMN1; SMN2EPHX1CES1 | |
| Trifluoroacetic Acid SCHEMBL5002924 | 0.76 | CES1 (0.52) | POLBCYP2C9SMN1; SMN2EPHX1CES1 | |
| Trifluoroacetic Acid SCHEMBL3994638 | 0.76 | CES1 (0.52) | POLBCYP2C9SMN1; SMN2EPHX1CES1 | |
| SCHEMBL64475 | 0.75 | POLB (0.62) | POLBCYP2C9SMN1; SMN2EPHX1CES1 | |
| Hydrochloric Acid SCHEMBL4002564 | 0.75 | HDAC3 (0.52) | POLBCYP2C9SMN1; SMN2EPHX1CES1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0863753-B1 | USE OF PERFLUOROALKYL DERIVATIVES OF AMINO ACIDS AS METALLO-BETA-LACTAMASE INHIBITORS | ISIS INNOVATION (GB) | 2002-07-17 | — | — | EP | disclosed |
| US-6043278-A | FORMULATION COMPRISING MIXTURE OF BETA-LACTAM ANTIBIOTIC AND PERFLUOROLOWERALKYL DERIVATIVE OF AMINO ACID | ISIS INNOVATION LIMITED (GB) | 2000-03-28 | — | — | US | disclosed |