Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 4/20 | 1.00 |
| ▸ | NPC1 | O15118 | 3/20 | 1.00 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.59 |
| ▸ | HTR2B | P41595 | 1/20 | 0.53 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.53 |
| ▸ | KMO | O15229 | 2/20 | 0.53 |
| ▸ | AHR | P35869 | 2/20 | 0.52 |
| ▸ | DHFR | P00374 | 1/20 | 0.51 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.48 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.48 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | CYP1B1 | Q16678 | 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 | |
|---|---|---|---|---|
| SCHEMBL10923751 | 0.90 | RAB9A (0.82) | RAB9ANPC1HRH4HTR2BPDE4D | |
| SCHEMBL9566620 | 0.86 | RAB9A (0.75) | RAB9ANPC1HRH4HTR2BPDE4D | |
| SCHEMBL9566548 | 0.86 | RAB9A (0.75) | RAB9ANPC1HRH4HTR2BPDE4D | |
| SCHEMBL9566515 | 0.82 | RAB9A (0.70) | RAB9ANPC1HRH4HTR2BPDE4D | |
| SCHEMBL9566490 | 0.82 | RAB9A (0.70) | RAB9ANPC1HRH4HTR2BPDE4D | |
| SCHEMBL10923642 | 0.79 | RAB9A (0.64) | RAB9ANPC1HRH4HTR2BPDE4D | |
| SCHEMBL11787160 | 0.78 | NPC1 (0.64) | RAB9ANPC1HRH4KMOAHR | |
| SCHEMBL9566413 | 0.78 | HRH4 (0.66) | RAB9ANPC1HRH4KMOADORA1 | |
| SCHEMBL5071653 | 0.77 | RAB9A (0.62) | RAB9ANPC1HRH4HTR2BPDE4D | |
| SCHEMBL28880529 | 0.77 | RAB9A (0.76) | RAB9ANPC1DHFRADORA1POLB |
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-0563386-A1 | ANTICANCER COMPOSITION AND COMPOUND | NIPPON SHINYAKU COMPANY, LIMITED (JP) | 1993-10-06 | — | — | EP | disclosed |