Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 9/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.35 |
| ▸ | SMPD3 | Q9NY59 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HMGCR | P04035 | 1/20 | 0.33 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.33 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL21286983 | 0.82 | HTT (0.43) | ALOX5HPGDMAPK1NPC1HTT | |
| SCHEMBL5141831 | 0.75 | ACHE (0.48) | ALOX5HPGDMAPK1NPC1HTT | |
| SCHEMBL27947309 | 0.73 | NPC1 (0.48) | ALOX5HPGDMAPK1NPC1HTT | |
| SCHEMBL2916167 | 0.71 | ALOX5 (0.37) | ALOX5HPGDMAPK1PTGS2CNR2 | |
| SCHEMBL7196531 | 0.71 | ALDH1A1 (0.47) | ALOX5HPGDMAPK1HTR2AALDH1A1 | |
| SCHEMBL10752271 | 0.70 | ALOX5 (0.44) | ALOX5HPGDMAPK1NPC1HTT | |
| SCHEMBL24089462 | 0.70 | ALOX5 (0.46) | ALOX5HPGDMAPK1PTGS2ALDH1A1 | |
| SCHEMBL13296654 | 0.69 | ALOX5 (0.54) | ALOX5PTGS2CNR2HTR2A | |
| Methane SCHEMBL23966331 | 0.69 | ALOX5 (0.40) | ALOX5HPGDMAPK1NPC1HTT | |
| SCHEMBL18295989 | 0.69 | APP (0.32) | PTGS2HTR2ACYP1A2CYP3A4CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-102448920-B | Antiviral compounds and uses thereof | ABBVIE (US) | 2016-04-06 | — | — | CN | disclosed |