Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 6/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.56 |
| ▸ | MAPT | P10636 | 4/20 | 0.56 |
| ▸ | HPGD | P15428 | 3/20 | 0.56 |
| ▸ | CCR4 | P51679 | 2/20 | 0.53 |
| ▸ | SCD | O00767 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.52 |
| ▸ | RAB9A | P51151 | 5/20 | 0.52 |
| ▸ | NPC1 | O15118 | 4/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL31268017 | 0.86 | CCR4 (0.56) | GAAALDH1A1MAPTHPGDCCR4 | |
| SCHEMBL31268014 | 0.84 | CCR4 (0.51) | GAAALDH1A1MAPTCCR4SCD | |
| SCHEMBL31267963 | 0.74 | GAA (0.56) | GAAALDH1A1MAPTHPGDSCD | |
| SCHEMBL31268056 | 0.74 | GAA (0.52) | GAAALDH1A1MAPTHPGDCCR4 | |
| SCHEMBL10657847 | 0.72 | BACE1 (0.53) | GAAALDH1A1MAPTHPGDCCR4 | |
| SCHEMBL2424998 | 0.72 | KDM4E (0.70) | GAAALDH1A1MAPTKDM4ENPC1 | |
| SCHEMBL1330213 | 0.72 | GCK (0.52) | GAAALDH1A1MAPTHPGDSCD | |
| Hydrochloric Acid SCHEMBL1329737 | 0.71 | GCK (0.51) | GAAALDH1A1MAPTHPGDSCD | |
| SCHEMBL31267977 | 0.71 | CCR4 (0.53) | GAAMAPTHPGDCCR4RAB9A | |
| SCHEMBL3511612 | 0.71 | LMNA (0.59) | ALDH1A1MAPTKDM4ERAB9AKMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4676475-A1 | HIV-1P ROTEASE INHIBITORS AND USES THEREOF | Purdue Research Foundation (US) | 2026-01-14 | — | — | EP | disclosed |
| WO-2024206093-A1 | HIV-1P ROTEASE INHIBITORS AND USES THEREOF | PURDUE RESEARCH FOUNDATION (US) | 2024-10-03 | — | — | WO | disclosed |