Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.56 |
| ▸ | RAB9A | P51151 | 5/20 | 0.56 |
| ▸ | MAPT | P10636 | 4/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.56 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
| ▸ | MMP8 | P22894 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 2/20 | 0.50 |
| ▸ | CES2 | O00748 | 1/20 | 0.49 |
| ▸ | CES1 | P23141 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | MITF | O75030 | 1/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.45 |
| ▸ | CNR2 | P34972 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL13228062 | 0.89 | TDP1 (0.50) | NPC1RAB9AMAPTNPSR1L3MBTL1 | |
| SCHEMBL6908528 | 0.88 | MMP8 (0.64) | NPC1MAPTL3MBTL1MMP8MEN1 | |
| SCHEMBL8200333 | 0.87 | MMP8 (0.55) | NPC1RAB9AMAPTMMP8MEN1 | |
| SCHEMBL5083265 | 0.86 | SMN1; SMN2 (0.46) | NPC1RAB9AMAPTNPSR1PAX8 | |
| SCHEMBL1043694 | 0.85 | ALOX15 (0.51) | NPC1RAB9AMAPTNPSR1PAX8 | |
| SCHEMBL7093633 | 0.84 | MMP8 (0.52) | NPC1RAB9AMAPTNPSR1L3MBTL1 | |
| SCHEMBL6642403 | 0.83 | NPC1 (0.63) | NPC1RAB9AMAPTNPSR1PAX8 | |
| SCHEMBL7368797 | 0.83 | MMP8 (0.50) | NPC1RAB9AMAPTNPSR1PAX8 | |
| SCHEMBL3791834 | 0.83 | CA12 (0.53) | ALDH1A1HSD17B10 | |
| SCHEMBL23674188 | 0.82 | NPC1 (0.61) | NPC1RAB9AMAPTNPSR1PAX8 |
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-2003084935-A2 | DIARYL PYRIMIDINONE DERIVATIVES USEFUL FOR THE TREATMENT OF INFLAMMATION AND IMMUNOGOLICAL DISEASES | ORCHID CHEMICALS & PHARMACEUTICALS LTD (IN) | 2003-10-16 | — | — | WO | disclosed |