Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 4/20 | 0.46 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 7/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | PKM | P14618 | 2/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.44 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.44 |
| ▸ | RELA | Q04206 | 2/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | CNR2 | P34972 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 6/20 | 0.43 |
| ▸ | TP53 | P04637 | 4/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3737284 | 0.88 | NPC1 (0.50) | S1PR1S1PR5NPC1SMN1; SMN2HSD17B10 | |
| SCHEMBL3736934 | 0.87 | NPC1 (0.49) | S1PR1S1PR5NPC1SMN1; SMN2HSD17B10 | |
| SCHEMBL14176247 | 0.86 | CNR2 (0.49) | S1PR1S1PR5NPC1SMN1; SMN2HSD17B10 | |
| SCHEMBL3739680 | 0.86 | NPC1 (0.50) | S1PR1S1PR5NPC1SMN1; SMN2HSD17B10 | |
| SCHEMBL3739642 | 0.84 | NPC1 (0.52) | S1PR1S1PR5NPC1SMN1; SMN2HSD17B10 | |
| SCHEMBL14176251 | 0.81 | NPC1 (0.47) | S1PR1NPC1SMN1; SMN2HSD17B10MAPT | |
| SCHEMBL3739814 | 0.80 | NPC1 (0.48) | S1PR1S1PR5NPC1SMN1; SMN2HSD17B10 | |
| SCHEMBL14176232 | 0.77 | NPC1 (0.47) | S1PR1NPC1SMN1; SMN2HSD17B10MAPT | |
| SCHEMBL3741053 | 0.74 | NPC1 (0.53) | S1PR1S1PR5NPC1SMN1; SMN2HSD17B10 | |
| SCHEMBL3739633 | 0.73 | NPC1 (0.52) | S1PR1S1PR5NPC1SMN1; SMN2HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008076356-A1 | NOVEL OXADIAZOLE COMPOUNDS | ABBOTT LABORATORIES (US) | 2008-06-26 | — | — | WO | disclosed |