Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | LPAR3 | Q9UBY5 | 10/20 | 0.42 |
| ▸ | LPAR2 | Q9HBW0 | 6/20 | 0.42 |
| ▸ | LPAR1 | Q92633 | 5/20 | 0.42 |
| ▸ | FDPS | P14324 | 5/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | LPAR5 | Q9H1C0 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6667933 | 0.90 | FDPS (0.42) | LPAR3LPAR2LPAR1FDPSLPAR5 | |
| SCHEMBL5075884 | 0.82 | FDPS (0.45) | FDPSTSHR | |
| SCHEMBL6670360 | 0.82 | FDPS (0.45) | FDPSTSHR | |
| SCHEMBL17032638 | 0.72 | CYP3A4 (0.54) | CYP3A4LPAR3LPAR2LPAR1FDPS | |
| SCHEMBL10861326 | 0.72 | CYP3A4 (0.48) | CYP3A4LPAR3LPAR2LPAR1FDPS | |
| Ammonia Solution, Strong SCHEMBL10862311 | 0.72 | CYP3A4 (0.48) | CYP3A4LPAR3LPAR2LPAR1FDPS | |
| SCHEMBL6668405 | 0.71 | FDPS (0.41) | FDPSTSHR | |
| SCHEMBL9302643 | 0.71 | FDPS (0.38) | FDPSTSHR | |
| SCHEMBL8339034 | 0.71 | ANPEP (0.38) | FDPS | |
| SCHEMBL9301817 | 0.71 | FDPS (0.38) | FDPSTSHR |
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-0882055-B1 | POLYAZAMACROCYCLOFLUOROMONOALKYLPHOSPHONIC ACIDS, AND THEIR COMPLEXES, FOR USE AS CONTRAST AGENTS | DOW GLOBAL TECHNOLOGIES INC (US) | 2004-09-22 | — | — | EP | disclosed |
| US-5834456-A | MAGNETIC RESONANCE IMAGING AND IN VIVO SPECTROSCOPY OF FLUORINE; SENSITIVITY, TISSUE DISTRIBUTION | THE DOW CHEMICAL COMPANY (US) | 1998-11-10 | — | — | US | disclosed |
| US-5362476-A | Contrast agents for magnetic resonance imaging | BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) | 1994-11-08 | — | — | US | disclosed |