Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | PTGS2 | P35354 | 7/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | EGFR | P00533 | 1/20 | 0.42 |
| ▸ | TYR | P14679 | 1/20 | 0.42 |
| ▸ | ALOX5 | P09917 | 4/20 | 0.40 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL201692 | 0.90 | NPC1 (0.57) | NPC1HPGDMAPK1HTTRAB9A | |
| SCHEMBL14293908 | 0.89 | EGFR (0.44) | NPC1HPGDMAPK1HTTRAB9A | |
| SCHEMBL28215541 | 0.88 | NPC1 (0.55) | NPC1HPGDMAPK1HTTRAB9A | |
| SCHEMBL28031372 | 0.88 | NPC1 (0.55) | NPC1HPGDMAPK1HTTRAB9A | |
| SCHEMBL27977349 | 0.88 | NPC1 (0.55) | NPC1HPGDMAPK1HTTRAB9A | |
| SCHEMBL1022838 | 0.86 | NPC1 (0.53) | NPC1HPGDMAPK1HTTRAB9A | |
| SCHEMBL11801101 | 0.86 | PTGS2 (0.61) | NPC1HPGDMAPK1HTTRAB9A | |
| SCHEMBL7147152 | 0.85 | PTGS2 (0.62) | NPC1HPGDMAPK1HTTRAB9A | |
| SCHEMBL13124313 | 0.85 | PTGS2 (0.62) | NPC1HPGDMAPK1HTTRAB9A | |
| SCHEMBL7985811 | 0.85 | PTGS2 (0.62) | NPC1HPGDMAPK1HTTRAB9A |
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-3707242-B1 | COMPOUNDS FOR USE IN THE ELIMINATION OF PLURIPOTENT STEM CELLS | UNIV KOELN (DE) | 2022-05-18 | — | — | EP | disclosed |