Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR4 | P51679 | 2/20 | 0.56 |
| ▸ | GAA | P10253 | 6/20 | 0.55 |
| ▸ | MAPT | P10636 | 5/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.55 |
| ▸ | RAB9A | P51151 | 5/20 | 0.54 |
| ▸ | NPC1 | O15118 | 4/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.51 |
| ▸ | HPGD | P15428 | 3/20 | 0.51 |
| ▸ | SCD | O00767 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 3/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL31267935 | 0.86 | GAA (0.56) | CCR4GAAMAPTALDH1A1KDM4E | |
| SCHEMBL31267977 | 0.83 | CCR4 (0.53) | CCR4GAAMAPTRAB9ANPC1 | |
| SCHEMBL6182547 | 0.82 | RAB9A (0.54) | CCR4MAPTRAB9ANPC1KMT2A | |
| SCHEMBL31268012 | 0.80 | NPC1 (0.66) | GAAMAPTALDH1A1KDM4ERAB9A | |
| SCHEMBL6252872 | 0.79 | RAB9A (0.64) | CCR4GAAMAPTALDH1A1KDM4E | |
| SCHEMBL15283117 | 0.74 | RAB9A (0.74) | GAAMAPTALDH1A1KDM4ERAB9A | |
| SCHEMBL4902354 | 0.74 | GAA (0.57) | CCR4GAAMAPTALDH1A1KDM4E | |
| SCHEMBL2170704 | 0.73 | CCR4 (0.53) | CCR4GAAMAPTALDH1A1KDM4E | |
| SCHEMBL21635744 | 0.72 | MAPK8 (0.52) | MAPTALDH1A1KDM4ERAB9ANPC1 | |
| SCHEMBL3364062 | 0.72 | FABP4 (0.66) | MAPTKDM4ERAB9ANPC1KMT2A |
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 |