Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | RARB | P10826 | 3/20 | 0.46 |
| ▸ | S1PR1 | P21453 | 5/20 | 0.44 |
| ▸ | S1PR3 | Q99500 | 3/20 | 0.44 |
| ▸ | S1PR4 | O95977 | 2/20 | 0.44 |
| ▸ | S1PR5 | Q9H228 | 2/20 | 0.44 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.44 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.42 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.42 |
| ▸ | BCL2 | P10415 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.42 |
| ▸ | RELA | Q04206 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | PPARG | P37231 | 2/20 | 0.41 |
| ▸ | PPARA | Q07869 | 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 | |
|---|---|---|---|---|
| SCHEMBL8692695 | 1.00 | NPC1 (0.47) | NPC1RAB9AMEN1KMT2ARARB | |
| SCHEMBL8690348 | 1.00 | NPC1 (0.47) | NPC1RAB9AMEN1KMT2ARARB | |
| SCHEMBL8691041 | 0.88 | FFAR1 (0.48) | FFAR1BCL2 | |
| SCHEMBL8690355 | 0.88 | FFAR1 (0.48) | FFAR1BCL2 | |
| SCHEMBL8505440 | 0.87 | S1PR1 (0.48) | NPC1RAB9AMEN1KMT2ARARB | |
| SCHEMBL8692922 | 0.81 | ALDH1A1 (0.40) | SCN5ASCN2AMAPTPPARGPPARA | |
| SCHEMBL8688113 | 0.81 | ALDH1A1 (0.40) | SCN5ASCN2AMAPTPPARGPPARA | |
| SCHEMBL28544647 | 0.75 | ALDH1A1 (0.49) | SCN5ATSHR | |
| SCHEMBL8502674 | 0.75 | LTA4H (0.54) | NPC1RAB9AFFAR1BCL2SMN1; SMN2 | |
| Bicarbonate SCHEMBL7805312 | 0.71 | RARB (0.74) | RARBTP53TSHR |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5789434-A | ACID, ESTER OR AMIDE DERIVATIVES AS ANTIINFLAMMATORY AGENTS, ANTIARTHRITIC AGENTS AND REDUCTION OF CARTILAGE DETERIORATION | BAYER CORPORATION (US) | 1998-08-04 | — | — | US | disclosed |