Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 2/20 | 0.61 |
| ▸ | NPC1 | O15118 | 6/20 | 0.54 |
| ▸ | RAB9A | P51151 | 6/20 | 0.54 |
| ▸ | PPARA | Q07869 | 3/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | CASP3 | P42574 | 1/20 | 0.50 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.50 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.50 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | PKM | P14618 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.48 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.48 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL5206252 | 0.91 | NPC1 (0.66) | PTPN1NPC1RAB9APPARAALDH1A1 | |
| SCHEMBL17336802 | 0.88 | NPC1 (0.62) | PTPN1NPC1RAB9APPARAALDH1A1 | |
| SCHEMBL4876695 | 0.87 | NPC1 (0.68) | NPC1RAB9APPARAALDH1A1MAPT | |
| SCHEMBL1505371 | 0.87 | NPC1 (0.68) | PTPN1NPC1RAB9APPARAALDH1A1 | |
| SCHEMBL12171547 | 0.87 | NPC1 (0.53) | PTPN1NPC1RAB9APPARAALDH1A1 | |
| SCHEMBL6923210 | 0.85 | NPC1 (0.50) | PTPN1NPC1RAB9APPARAALDH1A1 | |
| SCHEMBL935623 | 0.85 | NPC1 (0.50) | PTPN1NPC1RAB9APPARAALDH1A1 | |
| SCHEMBL959372 | 0.84 | TP53 (0.65) | PTPN1NPC1RAB9APPARAALDH1A1 | |
| SCHEMBL12798225 | 0.84 | NPC1 (0.71) | PTPN1NPC1RAB9APPARAALDH1A1 | |
| SCHEMBL12171379 | 0.84 | MAPT (0.53) | NPC1RAB9APPARAALDH1A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011009484-A1 | ARYLPYRAZOLES AND ARYLISOXAZOLES AND THEIR USE AS PKD MODULATORS | NOVARTIS AG (CH) | 2011-01-27 | — | — | WO | disclosed |
| WO-2011009484-A1 | ARYLPYRAZOLES AND ARYLISOXAZOLES AND THEIR USE AS PKD MODULATORS | NOVARTIS AG (CH) | 2011-01-27 | — | — | WO | disclosed |