Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 4/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | HSPA5 | P11021 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 2/20 | 0.32 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.32 |
| ▸ | LTB4R | Q15722 | 2/20 | 0.31 |
| ▸ | CBS | P35520 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL15057210 | 0.85 | HSPA5 (0.34) | HSPA5MAPK1HTTGAA | |
| SCHEMBL23750555 | 0.83 | MAPK1 (0.41) | PTGS2CYP3A4NPC1HPGDMAPK1 | |
| SCHEMBL25995161 | 0.76 | ALOX15 (0.41) | PTGS2CYP3A4HSPA5NPC1HPGD | |
| SCHEMBL201692 | 0.74 | NPC1 (0.57) | PTGS2CYP3A4NPC1HPGDMAPK1 | |
| SCHEMBL28031372 | 0.72 | NPC1 (0.55) | PTGS2CYP3A4NPC1HPGDMAPK1 | |
| SCHEMBL28215541 | 0.72 | NPC1 (0.55) | PTGS2CYP3A4NPC1HPGDMAPK1 | |
| SCHEMBL27977349 | 0.72 | NPC1 (0.55) | PTGS2CYP3A4NPC1HPGDMAPK1 | |
| SCHEMBL1160403 | 0.72 | PTGS2 (0.63) | PTGS2CYP3A4NPC1HPGDMAPK1 | |
| SCHEMBL25995194 | 0.71 | ALOX15 (0.40) | PTGS2CYP3A4NPC1HPGDMAPK1 | |
| SCHEMBL201605 | 0.71 | PTGS2 (0.64) | PTGS2CYP3A4HTT |
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 |
|---|---|---|---|---|---|---|---|
| EP-0254097-A2 | Catalyst mixtures for polyisocyanurate foam | THE CELOTEX CORPORATION (US) | 1988-01-27 | — | — | EP | disclosed |